USER MOD reduce.3.24.130724 H: found=0, std=0, add=596, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 597 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 140 LYS NZ :NH3+ -128:sc= 0.0916 (180deg=0) USER MOD Set 1.2: A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 CYS SG : rot 180:sc= -0.0134 USER MOD Single : A 119 CYS SG : rot 134:sc= 1.19 USER MOD Single : A 126 SER OG : rot 130:sc= 0.0292 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 THR OG1 : rot 97:sc= 1.21 USER MOD Single : A 130 THR OG1 : rot -62:sc= 1.26 USER MOD Single : A 139 SER OG : rot -85:sc= 1.05 USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 151 TYR OH : rot 174:sc= 0.00996 USER MOD Single : A 153 GLN : amide:sc= 0.771 K(o=0.77,f=-7.5!) USER MOD Single : A 154 GLN : amide:sc= 0 X(o=0,f=-0.076) USER MOD Single : A 155 SER OG : rot 180:sc= 0.603 USER MOD Single : A 158 SER OG : rot 180:sc= 0.265 USER MOD Single : A 165 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 ASN : amide:sc= 0.256 K(o=0.26,f=-7.2!) USER MOD Single : A 173 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 LYS NZ :NH3+ 175:sc= 1.31 (180deg=1.23) USER MOD Single : A 180 ASN : amide:sc= 0.937 K(o=0.94,f=-4.8!) USER MOD Single : A 182 MET CE :methyl -136:sc= -0.558 (180deg=-1.16) USER MOD ----------------------------------------------------------------- ATOM 163 N CYS A 118 -4.116 3.495 -10.550 1.00 0.00 N ATOM 164 CA CYS A 118 -4.381 4.467 -9.475 1.00 0.00 C ATOM 165 C CYS A 118 -4.176 3.925 -8.043 1.00 0.00 C ATOM 166 O CYS A 118 -4.062 4.716 -7.108 1.00 0.00 O ATOM 167 CB CYS A 118 -5.815 4.996 -9.654 1.00 0.00 C ATOM 168 SG CYS A 118 -6.055 5.695 -11.316 1.00 0.00 S ATOM 0 HA CYS A 118 -3.642 5.263 -9.572 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -6.527 4.187 -9.490 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -6.021 5.758 -8.903 1.00 0.00 H new ATOM 0 HG CYS A 118 -7.275 6.129 -11.432 1.00 0.00 H new ATOM 174 N CYS A 119 -4.124 2.603 -7.850 1.00 0.00 N ATOM 175 CA CYS A 119 -3.928 1.972 -6.541 1.00 0.00 C ATOM 176 C CYS A 119 -2.514 1.384 -6.393 1.00 0.00 C ATOM 177 O CYS A 119 -2.041 0.653 -7.268 1.00 0.00 O ATOM 178 CB CYS A 119 -5.024 0.917 -6.337 1.00 0.00 C ATOM 179 SG CYS A 119 -4.886 0.217 -4.665 1.00 0.00 S ATOM 0 H CYS A 119 -4.218 1.931 -8.611 1.00 0.00 H new ATOM 0 HA CYS A 119 -4.012 2.726 -5.758 1.00 0.00 H new ATOM 0 HB2 CYS A 119 -6.007 1.367 -6.475 1.00 0.00 H new ATOM 0 HB3 CYS A 119 -4.928 0.128 -7.083 1.00 0.00 H new ATOM 0 HG CYS A 119 -6.064 0.165 -4.118 1.00 0.00 H new ATOM 185 N LEU A 120 -1.874 1.657 -5.254 1.00 0.00 N ATOM 186 CA LEU A 120 -0.625 1.037 -4.817 1.00 0.00 C ATOM 187 C LEU A 120 -0.882 0.094 -3.642 1.00 0.00 C ATOM 188 O LEU A 120 -1.660 0.409 -2.739 1.00 0.00 O ATOM 189 CB LEU A 120 0.385 2.110 -4.366 1.00 0.00 C ATOM 190 CG LEU A 120 0.773 3.172 -5.407 1.00 0.00 C ATOM 191 CD1 LEU A 120 1.886 4.044 -4.816 1.00 0.00 C ATOM 192 CD2 LEU A 120 1.256 2.557 -6.726 1.00 0.00 C ATOM 0 H LEU A 120 -2.227 2.343 -4.586 1.00 0.00 H new ATOM 0 HA LEU A 120 -0.218 0.480 -5.661 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -0.027 2.621 -3.496 1.00 0.00 H new ATOM 0 HB3 LEU A 120 1.294 1.606 -4.039 1.00 0.00 H new ATOM 0 HG LEU A 120 -0.115 3.761 -5.635 1.00 0.00 H new ATOM 0 HD11 LEU A 120 2.176 4.805 -5.541 1.00 0.00 H new ATOM 0 HD12 LEU A 120 1.526 4.527 -3.907 1.00 0.00 H new ATOM 0 HD13 LEU A 120 2.749 3.422 -4.579 1.00 0.00 H new ATOM 0 HD21 LEU A 120 1.517 3.352 -7.424 1.00 0.00 H new ATOM 0 HD22 LEU A 120 2.133 1.937 -6.539 1.00 0.00 H new ATOM 0 HD23 LEU A 120 0.463 1.944 -7.154 1.00 0.00 H new ATOM 204 N GLY A 121 -0.194 -1.045 -3.643 1.00 0.00 N ATOM 205 CA GLY A 121 -0.082 -1.944 -2.499 1.00 0.00 C ATOM 206 C GLY A 121 1.180 -1.585 -1.715 1.00 0.00 C ATOM 207 O GLY A 121 2.202 -1.231 -2.305 1.00 0.00 O ATOM 0 H GLY A 121 0.315 -1.377 -4.463 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -0.961 -1.855 -1.861 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -0.036 -2.980 -2.835 1.00 0.00 H new ATOM 211 N VAL A 122 1.100 -1.669 -0.391 1.00 0.00 N ATOM 212 CA VAL A 122 2.142 -1.255 0.560 1.00 0.00 C ATOM 213 C VAL A 122 2.359 -2.405 1.542 1.00 0.00 C ATOM 214 O VAL A 122 1.407 -2.877 2.156 1.00 0.00 O ATOM 215 CB VAL A 122 1.748 0.042 1.306 1.00 0.00 C ATOM 216 CG1 VAL A 122 2.863 0.483 2.270 1.00 0.00 C ATOM 217 CG2 VAL A 122 1.449 1.200 0.336 1.00 0.00 C ATOM 0 H VAL A 122 0.273 -2.043 0.075 1.00 0.00 H new ATOM 0 HA VAL A 122 3.065 -1.035 0.023 1.00 0.00 H new ATOM 0 HB VAL A 122 0.842 -0.189 1.866 1.00 0.00 H new ATOM 0 HG11 VAL A 122 2.561 1.397 2.782 1.00 0.00 H new ATOM 0 HG12 VAL A 122 3.041 -0.303 3.005 1.00 0.00 H new ATOM 0 HG13 VAL A 122 3.778 0.668 1.708 1.00 0.00 H new ATOM 0 HG21 VAL A 122 1.177 2.090 0.904 1.00 0.00 H new ATOM 0 HG22 VAL A 122 2.334 1.410 -0.264 1.00 0.00 H new ATOM 0 HG23 VAL A 122 0.624 0.922 -0.319 1.00 0.00 H new ATOM 227 N PHE A 123 3.604 -2.864 1.678 1.00 0.00 N ATOM 228 CA PHE A 123 3.970 -4.098 2.378 1.00 0.00 C ATOM 229 C PHE A 123 5.127 -3.866 3.358 1.00 0.00 C ATOM 230 O PHE A 123 5.883 -2.904 3.216 1.00 0.00 O ATOM 231 CB PHE A 123 4.347 -5.164 1.330 1.00 0.00 C ATOM 232 CG PHE A 123 3.358 -5.346 0.188 1.00 0.00 C ATOM 233 CD1 PHE A 123 3.475 -4.561 -0.979 1.00 0.00 C ATOM 234 CD2 PHE A 123 2.330 -6.303 0.280 1.00 0.00 C ATOM 235 CE1 PHE A 123 2.560 -4.721 -2.034 1.00 0.00 C ATOM 236 CE2 PHE A 123 1.411 -6.458 -0.774 1.00 0.00 C ATOM 237 CZ PHE A 123 1.523 -5.664 -1.929 1.00 0.00 C ATOM 0 H PHE A 123 4.411 -2.373 1.293 1.00 0.00 H new ATOM 0 HA PHE A 123 3.119 -4.441 2.967 1.00 0.00 H new ATOM 0 HB2 PHE A 123 5.318 -4.904 0.908 1.00 0.00 H new ATOM 0 HB3 PHE A 123 4.466 -6.121 1.839 1.00 0.00 H new ATOM 0 HD1 PHE A 123 4.270 -3.835 -1.062 1.00 0.00 H new ATOM 0 HD2 PHE A 123 2.246 -6.920 1.162 1.00 0.00 H new ATOM 0 HE1 PHE A 123 2.654 -4.119 -2.926 1.00 0.00 H new ATOM 0 HE2 PHE A 123 0.619 -7.188 -0.696 1.00 0.00 H new ATOM 0 HZ PHE A 123 0.813 -5.779 -2.735 1.00 0.00 H new ATOM 247 N GLY A 124 5.278 -4.745 4.357 1.00 0.00 N ATOM 248 CA GLY A 124 6.347 -4.651 5.365 1.00 0.00 C ATOM 249 C GLY A 124 6.087 -3.572 6.421 1.00 0.00 C ATOM 250 O GLY A 124 7.033 -3.009 6.967 1.00 0.00 O ATOM 0 H GLY A 124 4.660 -5.546 4.491 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.457 -5.616 5.860 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.292 -4.440 4.864 1.00 0.00 H new ATOM 254 N LEU A 125 4.814 -3.260 6.685 1.00 0.00 N ATOM 255 CA LEU A 125 4.372 -2.229 7.630 1.00 0.00 C ATOM 256 C LEU A 125 4.525 -2.671 9.092 1.00 0.00 C ATOM 257 O LEU A 125 4.713 -3.849 9.397 1.00 0.00 O ATOM 258 CB LEU A 125 2.897 -1.876 7.325 1.00 0.00 C ATOM 259 CG LEU A 125 2.676 -1.127 5.996 1.00 0.00 C ATOM 260 CD1 LEU A 125 1.175 -1.057 5.685 1.00 0.00 C ATOM 261 CD2 LEU A 125 3.247 0.295 6.072 1.00 0.00 C ATOM 0 H LEU A 125 4.035 -3.736 6.230 1.00 0.00 H new ATOM 0 HA LEU A 125 5.007 -1.352 7.502 1.00 0.00 H new ATOM 0 HB2 LEU A 125 2.313 -2.796 7.309 1.00 0.00 H new ATOM 0 HB3 LEU A 125 2.508 -1.265 8.140 1.00 0.00 H new ATOM 0 HG LEU A 125 3.192 -1.670 5.205 1.00 0.00 H new ATOM 0 HD11 LEU A 125 1.023 -0.527 4.745 1.00 0.00 H new ATOM 0 HD12 LEU A 125 0.773 -2.067 5.601 1.00 0.00 H new ATOM 0 HD13 LEU A 125 0.661 -0.528 6.488 1.00 0.00 H new ATOM 0 HD21 LEU A 125 3.080 0.805 5.123 1.00 0.00 H new ATOM 0 HD22 LEU A 125 2.750 0.844 6.872 1.00 0.00 H new ATOM 0 HD23 LEU A 125 4.317 0.247 6.275 1.00 0.00 H new ATOM 273 N SER A 126 4.443 -1.712 10.010 1.00 0.00 N ATOM 274 CA SER A 126 4.313 -1.987 11.446 1.00 0.00 C ATOM 275 C SER A 126 2.888 -2.462 11.760 1.00 0.00 C ATOM 276 O SER A 126 1.915 -1.942 11.203 1.00 0.00 O ATOM 277 CB SER A 126 4.650 -0.721 12.242 1.00 0.00 C ATOM 278 OG SER A 126 4.481 -0.917 13.635 1.00 0.00 O ATOM 0 H SER A 126 4.464 -0.718 9.783 1.00 0.00 H new ATOM 0 HA SER A 126 5.009 -2.776 11.731 1.00 0.00 H new ATOM 0 HB2 SER A 126 5.679 -0.426 12.038 1.00 0.00 H new ATOM 0 HB3 SER A 126 4.012 0.098 11.910 1.00 0.00 H new ATOM 0 HG SER A 126 5.285 -0.615 14.108 1.00 0.00 H new ATOM 284 N LEU A 127 2.734 -3.435 12.667 1.00 0.00 N ATOM 285 CA LEU A 127 1.422 -4.008 12.997 1.00 0.00 C ATOM 286 C LEU A 127 0.522 -3.042 13.797 1.00 0.00 C ATOM 287 O LEU A 127 -0.661 -3.317 13.993 1.00 0.00 O ATOM 288 CB LEU A 127 1.602 -5.366 13.704 1.00 0.00 C ATOM 289 CG LEU A 127 2.496 -6.389 12.966 1.00 0.00 C ATOM 290 CD1 LEU A 127 2.425 -7.739 13.692 1.00 0.00 C ATOM 291 CD2 LEU A 127 2.116 -6.573 11.488 1.00 0.00 C ATOM 0 H LEU A 127 3.508 -3.845 13.189 1.00 0.00 H new ATOM 0 HA LEU A 127 0.891 -4.176 12.060 1.00 0.00 H new ATOM 0 HB2 LEU A 127 2.025 -5.188 14.693 1.00 0.00 H new ATOM 0 HB3 LEU A 127 0.618 -5.811 13.853 1.00 0.00 H new ATOM 0 HG LEU A 127 3.512 -5.995 12.979 1.00 0.00 H new ATOM 0 HD11 LEU A 127 3.054 -8.464 13.175 1.00 0.00 H new ATOM 0 HD12 LEU A 127 2.776 -7.620 14.717 1.00 0.00 H new ATOM 0 HD13 LEU A 127 1.394 -8.094 13.700 1.00 0.00 H new ATOM 0 HD21 LEU A 127 2.782 -7.304 11.029 1.00 0.00 H new ATOM 0 HD22 LEU A 127 1.087 -6.926 11.418 1.00 0.00 H new ATOM 0 HD23 LEU A 127 2.209 -5.620 10.967 1.00 0.00 H new ATOM 303 N TYR A 128 1.065 -1.891 14.211 1.00 0.00 N ATOM 304 CA TYR A 128 0.361 -0.790 14.880 1.00 0.00 C ATOM 305 C TYR A 128 -0.014 0.375 13.931 1.00 0.00 C ATOM 306 O TYR A 128 -0.585 1.373 14.384 1.00 0.00 O ATOM 307 CB TYR A 128 1.229 -0.306 16.053 1.00 0.00 C ATOM 308 CG TYR A 128 1.600 -1.399 17.041 1.00 0.00 C ATOM 309 CD1 TYR A 128 0.658 -1.833 17.997 1.00 0.00 C ATOM 310 CD2 TYR A 128 2.873 -2.001 16.992 1.00 0.00 C ATOM 311 CE1 TYR A 128 0.986 -2.862 18.899 1.00 0.00 C ATOM 312 CE2 TYR A 128 3.208 -3.032 17.891 1.00 0.00 C ATOM 313 CZ TYR A 128 2.264 -3.466 18.849 1.00 0.00 C ATOM 314 OH TYR A 128 2.577 -4.464 19.724 1.00 0.00 O ATOM 0 H TYR A 128 2.057 -1.692 14.082 1.00 0.00 H new ATOM 0 HA TYR A 128 -0.594 -1.168 15.244 1.00 0.00 H new ATOM 0 HB2 TYR A 128 2.143 0.136 15.657 1.00 0.00 H new ATOM 0 HB3 TYR A 128 0.697 0.483 16.584 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -0.319 -1.374 18.037 1.00 0.00 H new ATOM 0 HD2 TYR A 128 3.596 -1.670 16.261 1.00 0.00 H new ATOM 0 HE1 TYR A 128 0.262 -3.191 19.630 1.00 0.00 H new ATOM 0 HE2 TYR A 128 4.185 -3.490 17.848 1.00 0.00 H new ATOM 0 HH TYR A 128 3.492 -4.771 19.556 1.00 0.00 H new ATOM 324 N THR A 129 0.290 0.262 12.626 1.00 0.00 N ATOM 325 CA THR A 129 -0.068 1.249 11.583 1.00 0.00 C ATOM 326 C THR A 129 -1.590 1.341 11.446 1.00 0.00 C ATOM 327 O THR A 129 -2.276 0.319 11.532 1.00 0.00 O ATOM 328 CB THR A 129 0.548 0.872 10.222 1.00 0.00 C ATOM 329 OG1 THR A 129 1.924 0.620 10.372 1.00 0.00 O ATOM 330 CG2 THR A 129 0.424 1.985 9.181 1.00 0.00 C ATOM 0 H THR A 129 0.804 -0.537 12.255 1.00 0.00 H new ATOM 0 HA THR A 129 0.332 2.216 11.887 1.00 0.00 H new ATOM 0 HB THR A 129 -0.002 -0.005 9.880 1.00 0.00 H new ATOM 0 HG1 THR A 129 2.072 -0.345 10.459 1.00 0.00 H new ATOM 0 HG21 THR A 129 0.876 1.659 8.244 1.00 0.00 H new ATOM 0 HG22 THR A 129 -0.629 2.213 9.016 1.00 0.00 H new ATOM 0 HG23 THR A 129 0.936 2.878 9.540 1.00 0.00 H new ATOM 338 N THR A 130 -2.110 2.547 11.194 1.00 0.00 N ATOM 339 CA THR A 130 -3.517 2.807 10.838 1.00 0.00 C ATOM 340 C THR A 130 -3.615 3.395 9.437 1.00 0.00 C ATOM 341 O THR A 130 -2.650 3.954 8.912 1.00 0.00 O ATOM 342 CB THR A 130 -4.203 3.737 11.849 1.00 0.00 C ATOM 343 OG1 THR A 130 -3.660 5.033 11.758 1.00 0.00 O ATOM 344 CG2 THR A 130 -4.093 3.244 13.293 1.00 0.00 C ATOM 0 H THR A 130 -1.549 3.398 11.232 1.00 0.00 H new ATOM 0 HA THR A 130 -4.037 1.849 10.862 1.00 0.00 H new ATOM 0 HB THR A 130 -5.262 3.746 11.590 1.00 0.00 H new ATOM 0 HG1 THR A 130 -2.706 5.005 11.982 1.00 0.00 H new ATOM 0 HG21 THR A 130 -4.598 3.946 13.957 1.00 0.00 H new ATOM 0 HG22 THR A 130 -4.560 2.263 13.379 1.00 0.00 H new ATOM 0 HG23 THR A 130 -3.042 3.171 13.574 1.00 0.00 H new ATOM 352 N GLU A 131 -4.798 3.317 8.832 1.00 0.00 N ATOM 353 CA GLU A 131 -5.080 3.963 7.551 1.00 0.00 C ATOM 354 C GLU A 131 -4.869 5.486 7.595 1.00 0.00 C ATOM 355 O GLU A 131 -4.535 6.075 6.570 1.00 0.00 O ATOM 356 CB GLU A 131 -6.512 3.643 7.094 1.00 0.00 C ATOM 357 CG GLU A 131 -6.700 2.184 6.651 1.00 0.00 C ATOM 358 CD GLU A 131 -7.062 1.178 7.751 1.00 0.00 C ATOM 359 OE1 GLU A 131 -6.893 1.462 8.961 1.00 0.00 O ATOM 360 OE2 GLU A 131 -7.518 0.076 7.370 1.00 0.00 O ATOM 0 H GLU A 131 -5.590 2.803 9.217 1.00 0.00 H new ATOM 0 HA GLU A 131 -4.367 3.560 6.832 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -7.202 3.859 7.909 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -6.778 4.303 6.268 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -7.481 2.156 5.892 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -5.779 1.851 6.173 1.00 0.00 H new ATOM 367 N ARG A 132 -4.995 6.123 8.770 1.00 0.00 N ATOM 368 CA ARG A 132 -4.699 7.543 8.967 1.00 0.00 C ATOM 369 C ARG A 132 -3.196 7.835 8.833 1.00 0.00 C ATOM 370 O ARG A 132 -2.822 8.812 8.181 1.00 0.00 O ATOM 371 CB ARG A 132 -5.248 7.977 10.336 1.00 0.00 C ATOM 372 CG ARG A 132 -5.156 9.497 10.533 1.00 0.00 C ATOM 373 CD ARG A 132 -5.716 9.952 11.887 1.00 0.00 C ATOM 374 NE ARG A 132 -7.179 9.773 11.973 1.00 0.00 N ATOM 375 CZ ARG A 132 -7.929 9.949 13.055 1.00 0.00 C ATOM 376 NH1 ARG A 132 -7.415 10.316 14.212 1.00 0.00 N ATOM 377 NH2 ARG A 132 -9.229 9.755 12.987 1.00 0.00 N ATOM 0 H ARG A 132 -5.310 5.655 9.620 1.00 0.00 H new ATOM 0 HA ARG A 132 -5.188 8.125 8.186 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -6.287 7.661 10.427 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -4.691 7.474 11.127 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -4.114 9.808 10.452 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -5.701 9.997 9.732 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -5.235 9.387 12.686 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -5.470 11.002 12.046 1.00 0.00 H new ATOM 0 HE ARG A 132 -7.660 9.487 11.120 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -6.411 10.474 14.297 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -8.021 10.442 15.022 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -9.657 9.471 12.106 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -9.809 9.889 13.816 1.00 0.00 H new ATOM 391 N ASP A 133 -2.332 6.974 9.383 1.00 0.00 N ATOM 392 CA ASP A 133 -0.874 7.087 9.229 1.00 0.00 C ATOM 393 C ASP A 133 -0.482 6.959 7.753 1.00 0.00 C ATOM 394 O ASP A 133 0.226 7.813 7.222 1.00 0.00 O ATOM 395 CB ASP A 133 -0.132 6.016 10.048 1.00 0.00 C ATOM 396 CG ASP A 133 -0.407 6.085 11.555 1.00 0.00 C ATOM 397 OD1 ASP A 133 -0.051 7.107 12.188 1.00 0.00 O ATOM 398 OD2 ASP A 133 -0.955 5.096 12.094 1.00 0.00 O ATOM 0 H ASP A 133 -2.623 6.177 9.949 1.00 0.00 H new ATOM 0 HA ASP A 133 -0.583 8.069 9.603 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -0.417 5.030 9.681 1.00 0.00 H new ATOM 0 HB3 ASP A 133 0.940 6.121 9.879 1.00 0.00 H new ATOM 403 N LEU A 134 -1.015 5.939 7.066 1.00 0.00 N ATOM 404 CA LEU A 134 -0.798 5.739 5.633 1.00 0.00 C ATOM 405 C LEU A 134 -1.256 6.955 4.823 1.00 0.00 C ATOM 406 O LEU A 134 -0.450 7.500 4.074 1.00 0.00 O ATOM 407 CB LEU A 134 -1.502 4.453 5.172 1.00 0.00 C ATOM 408 CG LEU A 134 -0.863 3.146 5.677 1.00 0.00 C ATOM 409 CD1 LEU A 134 -1.738 1.967 5.236 1.00 0.00 C ATOM 410 CD2 LEU A 134 0.564 2.942 5.144 1.00 0.00 C ATOM 0 H LEU A 134 -1.610 5.229 7.493 1.00 0.00 H new ATOM 0 HA LEU A 134 0.272 5.628 5.455 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -2.539 4.485 5.505 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -1.517 4.435 4.082 1.00 0.00 H new ATOM 0 HG LEU A 134 -0.798 3.206 6.763 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -1.296 1.035 5.588 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -2.737 2.077 5.658 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -1.804 1.950 4.148 1.00 0.00 H new ATOM 0 HD21 LEU A 134 0.967 2.006 5.531 1.00 0.00 H new ATOM 0 HD22 LEU A 134 0.544 2.905 4.055 1.00 0.00 H new ATOM 0 HD23 LEU A 134 1.195 3.770 5.468 1.00 0.00 H new ATOM 422 N ARG A 135 -2.482 7.459 5.018 1.00 0.00 N ATOM 423 CA ARG A 135 -2.970 8.648 4.323 1.00 0.00 C ATOM 424 C ARG A 135 -2.086 9.880 4.573 1.00 0.00 C ATOM 425 O ARG A 135 -1.783 10.607 3.629 1.00 0.00 O ATOM 426 CB ARG A 135 -4.440 8.889 4.713 1.00 0.00 C ATOM 427 CG ARG A 135 -5.231 9.421 3.520 1.00 0.00 C ATOM 428 CD ARG A 135 -6.729 9.510 3.842 1.00 0.00 C ATOM 429 NE ARG A 135 -7.532 9.760 2.629 1.00 0.00 N ATOM 430 CZ ARG A 135 -8.744 9.279 2.366 1.00 0.00 C ATOM 431 NH1 ARG A 135 -9.401 8.511 3.212 1.00 0.00 N ATOM 432 NH2 ARG A 135 -9.325 9.568 1.226 1.00 0.00 N ATOM 0 H ARG A 135 -3.159 7.051 5.662 1.00 0.00 H new ATOM 0 HA ARG A 135 -2.915 8.474 3.248 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -4.886 7.959 5.066 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -4.492 9.600 5.537 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -4.857 10.406 3.243 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -5.079 8.769 2.660 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -7.057 8.582 4.311 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -6.900 10.309 4.563 1.00 0.00 H new ATOM 0 HE ARG A 135 -7.115 10.363 1.920 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -8.981 8.264 4.108 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -10.329 8.163 2.970 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -8.847 10.159 0.546 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -10.254 9.201 1.020 1.00 0.00 H new ATOM 446 N GLU A 136 -1.588 10.082 5.796 1.00 0.00 N ATOM 447 CA GLU A 136 -0.670 11.183 6.120 1.00 0.00 C ATOM 448 C GLU A 136 0.720 11.010 5.467 1.00 0.00 C ATOM 449 O GLU A 136 1.287 11.981 4.963 1.00 0.00 O ATOM 450 CB GLU A 136 -0.567 11.322 7.650 1.00 0.00 C ATOM 451 CG GLU A 136 0.214 12.572 8.077 1.00 0.00 C ATOM 452 CD GLU A 136 0.169 12.759 9.601 1.00 0.00 C ATOM 453 OE1 GLU A 136 -0.764 13.428 10.105 1.00 0.00 O ATOM 454 OE2 GLU A 136 1.076 12.253 10.304 1.00 0.00 O ATOM 0 H GLU A 136 -1.809 9.486 6.593 1.00 0.00 H new ATOM 0 HA GLU A 136 -1.078 12.103 5.701 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -1.570 11.361 8.076 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -0.081 10.437 8.060 1.00 0.00 H new ATOM 0 HG2 GLU A 136 1.250 12.487 7.748 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -0.205 13.451 7.587 1.00 0.00 H new ATOM 461 N VAL A 137 1.252 9.785 5.425 1.00 0.00 N ATOM 462 CA VAL A 137 2.586 9.462 4.870 1.00 0.00 C ATOM 463 C VAL A 137 2.604 9.442 3.334 1.00 0.00 C ATOM 464 O VAL A 137 3.630 9.758 2.735 1.00 0.00 O ATOM 465 CB VAL A 137 3.082 8.111 5.442 1.00 0.00 C ATOM 466 CG1 VAL A 137 4.340 7.555 4.765 1.00 0.00 C ATOM 467 CG2 VAL A 137 3.390 8.268 6.935 1.00 0.00 C ATOM 0 H VAL A 137 0.762 8.965 5.783 1.00 0.00 H new ATOM 0 HA VAL A 137 3.265 10.258 5.175 1.00 0.00 H new ATOM 0 HB VAL A 137 2.273 7.405 5.254 1.00 0.00 H new ATOM 0 HG11 VAL A 137 4.615 6.608 5.229 1.00 0.00 H new ATOM 0 HG12 VAL A 137 4.142 7.396 3.705 1.00 0.00 H new ATOM 0 HG13 VAL A 137 5.159 8.266 4.879 1.00 0.00 H new ATOM 0 HG21 VAL A 137 3.739 7.317 7.337 1.00 0.00 H new ATOM 0 HG22 VAL A 137 4.163 9.024 7.069 1.00 0.00 H new ATOM 0 HG23 VAL A 137 2.487 8.575 7.462 1.00 0.00 H new ATOM 477 N PHE A 138 1.483 9.099 2.695 1.00 0.00 N ATOM 478 CA PHE A 138 1.384 8.948 1.237 1.00 0.00 C ATOM 479 C PHE A 138 0.702 10.126 0.517 1.00 0.00 C ATOM 480 O PHE A 138 0.945 10.311 -0.676 1.00 0.00 O ATOM 481 CB PHE A 138 0.720 7.600 0.901 1.00 0.00 C ATOM 482 CG PHE A 138 1.645 6.398 1.019 1.00 0.00 C ATOM 483 CD1 PHE A 138 1.920 5.815 2.273 1.00 0.00 C ATOM 484 CD2 PHE A 138 2.246 5.861 -0.137 1.00 0.00 C ATOM 485 CE1 PHE A 138 2.789 4.714 2.371 1.00 0.00 C ATOM 486 CE2 PHE A 138 3.112 4.757 -0.040 1.00 0.00 C ATOM 487 CZ PHE A 138 3.387 4.185 1.214 1.00 0.00 C ATOM 0 H PHE A 138 0.605 8.915 3.181 1.00 0.00 H new ATOM 0 HA PHE A 138 2.403 8.958 0.850 1.00 0.00 H new ATOM 0 HB2 PHE A 138 -0.133 7.454 1.564 1.00 0.00 H new ATOM 0 HB3 PHE A 138 0.330 7.644 -0.116 1.00 0.00 H new ATOM 0 HD1 PHE A 138 1.460 6.217 3.164 1.00 0.00 H new ATOM 0 HD2 PHE A 138 2.041 6.299 -1.102 1.00 0.00 H new ATOM 0 HE1 PHE A 138 2.997 4.275 3.335 1.00 0.00 H new ATOM 0 HE2 PHE A 138 3.566 4.348 -0.930 1.00 0.00 H new ATOM 0 HZ PHE A 138 4.056 3.341 1.289 1.00 0.00 H new ATOM 497 N SER A 139 -0.095 10.968 1.184 1.00 0.00 N ATOM 498 CA SER A 139 -0.746 12.111 0.504 1.00 0.00 C ATOM 499 C SER A 139 0.212 13.261 0.139 1.00 0.00 C ATOM 500 O SER A 139 -0.133 14.133 -0.661 1.00 0.00 O ATOM 501 CB SER A 139 -1.962 12.649 1.274 1.00 0.00 C ATOM 502 OG SER A 139 -1.618 13.128 2.565 1.00 0.00 O ATOM 0 H SER A 139 -0.307 10.889 2.178 1.00 0.00 H new ATOM 0 HA SER A 139 -1.097 11.689 -0.437 1.00 0.00 H new ATOM 0 HB2 SER A 139 -2.423 13.454 0.702 1.00 0.00 H new ATOM 0 HB3 SER A 139 -2.707 11.859 1.369 1.00 0.00 H new ATOM 0 HG SER A 139 -1.618 12.383 3.201 1.00 0.00 H new ATOM 508 N LYS A 140 1.455 13.228 0.637 1.00 0.00 N ATOM 509 CA LYS A 140 2.544 14.118 0.206 1.00 0.00 C ATOM 510 C LYS A 140 2.911 13.972 -1.290 1.00 0.00 C ATOM 511 O LYS A 140 3.614 14.820 -1.841 1.00 0.00 O ATOM 512 CB LYS A 140 3.756 13.896 1.133 1.00 0.00 C ATOM 513 CG LYS A 140 4.425 12.522 0.933 1.00 0.00 C ATOM 514 CD LYS A 140 5.433 12.180 2.042 1.00 0.00 C ATOM 515 CE LYS A 140 6.637 13.126 2.141 1.00 0.00 C ATOM 516 NZ LYS A 140 7.541 13.019 0.966 1.00 0.00 N ATOM 0 H LYS A 140 1.738 12.571 1.364 1.00 0.00 H new ATOM 0 HA LYS A 140 2.199 15.148 0.295 1.00 0.00 H new ATOM 0 HB2 LYS A 140 4.491 14.681 0.955 1.00 0.00 H new ATOM 0 HB3 LYS A 140 3.435 13.990 2.170 1.00 0.00 H new ATOM 0 HG2 LYS A 140 3.656 11.751 0.898 1.00 0.00 H new ATOM 0 HG3 LYS A 140 4.934 12.508 -0.031 1.00 0.00 H new ATOM 0 HD2 LYS A 140 4.911 12.180 2.999 1.00 0.00 H new ATOM 0 HD3 LYS A 140 5.799 11.166 1.879 1.00 0.00 H new ATOM 0 HE2 LYS A 140 6.282 14.153 2.230 1.00 0.00 H new ATOM 0 HE3 LYS A 140 7.198 12.902 3.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 8.516 12.863 1.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 7.243 12.220 0.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 7.497 13.899 0.413 1.00 0.00 H new ATOM 530 N TYR A 141 2.415 12.917 -1.950 1.00 0.00 N ATOM 531 CA TYR A 141 2.602 12.615 -3.376 1.00 0.00 C ATOM 532 C TYR A 141 1.346 12.878 -4.241 1.00 0.00 C ATOM 533 O TYR A 141 1.365 12.619 -5.446 1.00 0.00 O ATOM 534 CB TYR A 141 3.058 11.154 -3.499 1.00 0.00 C ATOM 535 CG TYR A 141 4.253 10.784 -2.638 1.00 0.00 C ATOM 536 CD1 TYR A 141 5.495 11.414 -2.846 1.00 0.00 C ATOM 537 CD2 TYR A 141 4.122 9.820 -1.617 1.00 0.00 C ATOM 538 CE1 TYR A 141 6.588 11.107 -2.016 1.00 0.00 C ATOM 539 CE2 TYR A 141 5.216 9.503 -0.790 1.00 0.00 C ATOM 540 CZ TYR A 141 6.455 10.151 -0.987 1.00 0.00 C ATOM 541 OH TYR A 141 7.520 9.872 -0.184 1.00 0.00 O ATOM 0 H TYR A 141 1.843 12.215 -1.480 1.00 0.00 H new ATOM 0 HA TYR A 141 3.359 13.295 -3.767 1.00 0.00 H new ATOM 0 HB2 TYR A 141 2.223 10.504 -3.235 1.00 0.00 H new ATOM 0 HB3 TYR A 141 3.303 10.951 -4.542 1.00 0.00 H new ATOM 0 HD1 TYR A 141 5.608 12.133 -3.643 1.00 0.00 H new ATOM 0 HD2 TYR A 141 3.176 9.321 -1.469 1.00 0.00 H new ATOM 0 HE1 TYR A 141 7.534 11.606 -2.167 1.00 0.00 H new ATOM 0 HE2 TYR A 141 5.108 8.767 -0.007 1.00 0.00 H new ATOM 0 HH TYR A 141 7.264 9.193 0.475 1.00 0.00 H new ATOM 551 N GLY A 142 0.259 13.397 -3.644 1.00 0.00 N ATOM 552 CA GLY A 142 -0.980 13.802 -4.327 1.00 0.00 C ATOM 553 C GLY A 142 -2.282 13.320 -3.659 1.00 0.00 C ATOM 554 O GLY A 142 -2.220 12.620 -2.645 1.00 0.00 O ATOM 0 H GLY A 142 0.219 13.551 -2.637 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -1.003 14.890 -4.389 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -0.953 13.425 -5.349 1.00 0.00 H new ATOM 558 N PRO A 143 -3.456 13.701 -4.214 1.00 0.00 N ATOM 559 CA PRO A 143 -4.787 13.353 -3.705 1.00 0.00 C ATOM 560 C PRO A 143 -5.010 11.841 -3.554 1.00 0.00 C ATOM 561 O PRO A 143 -4.688 11.062 -4.453 1.00 0.00 O ATOM 562 CB PRO A 143 -5.781 13.957 -4.703 1.00 0.00 C ATOM 563 CG PRO A 143 -5.022 15.146 -5.279 1.00 0.00 C ATOM 564 CD PRO A 143 -3.593 14.616 -5.342 1.00 0.00 C ATOM 0 HA PRO A 143 -4.914 13.748 -2.697 1.00 0.00 H new ATOM 0 HB2 PRO A 143 -6.057 13.242 -5.478 1.00 0.00 H new ATOM 0 HB3 PRO A 143 -6.704 14.268 -4.213 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -5.395 15.429 -6.263 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -5.102 16.027 -4.642 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -3.408 14.103 -6.286 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -2.871 15.430 -5.275 1.00 0.00 H new ATOM 572 N ILE A 144 -5.609 11.436 -2.429 1.00 0.00 N ATOM 573 CA ILE A 144 -5.937 10.039 -2.091 1.00 0.00 C ATOM 574 C ILE A 144 -7.444 9.926 -1.844 1.00 0.00 C ATOM 575 O ILE A 144 -8.001 10.647 -1.013 1.00 0.00 O ATOM 576 CB ILE A 144 -5.088 9.548 -0.889 1.00 0.00 C ATOM 577 CG1 ILE A 144 -3.607 9.422 -1.318 1.00 0.00 C ATOM 578 CG2 ILE A 144 -5.590 8.196 -0.344 1.00 0.00 C ATOM 579 CD1 ILE A 144 -2.644 9.023 -0.194 1.00 0.00 C ATOM 0 H ILE A 144 -5.890 12.092 -1.700 1.00 0.00 H new ATOM 0 HA ILE A 144 -5.684 9.382 -2.924 1.00 0.00 H new ATOM 0 HB ILE A 144 -5.185 10.283 -0.090 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -3.536 8.684 -2.117 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -3.282 10.375 -1.735 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -4.968 7.889 0.497 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -6.623 8.298 -0.012 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -5.534 7.443 -1.131 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -1.630 8.960 -0.589 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -2.679 9.771 0.598 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -2.937 8.054 0.210 1.00 0.00 H new ATOM 591 N ALA A 145 -8.093 9.008 -2.561 1.00 0.00 N ATOM 592 CA ALA A 145 -9.527 8.738 -2.503 1.00 0.00 C ATOM 593 C ALA A 145 -9.904 7.751 -1.379 1.00 0.00 C ATOM 594 O ALA A 145 -10.964 7.897 -0.769 1.00 0.00 O ATOM 595 CB ALA A 145 -9.948 8.193 -3.876 1.00 0.00 C ATOM 0 H ALA A 145 -7.610 8.406 -3.228 1.00 0.00 H new ATOM 0 HA ALA A 145 -10.056 9.662 -2.269 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -11.017 7.979 -3.870 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -9.730 8.935 -4.644 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -9.396 7.278 -4.089 1.00 0.00 H new ATOM 601 N ASP A 146 -9.033 6.785 -1.068 1.00 0.00 N ATOM 602 CA ASP A 146 -9.271 5.715 -0.087 1.00 0.00 C ATOM 603 C ASP A 146 -7.958 5.039 0.365 1.00 0.00 C ATOM 604 O ASP A 146 -6.923 5.176 -0.287 1.00 0.00 O ATOM 605 CB ASP A 146 -10.251 4.674 -0.676 1.00 0.00 C ATOM 606 CG ASP A 146 -10.957 3.794 0.374 1.00 0.00 C ATOM 607 OD1 ASP A 146 -10.738 3.997 1.593 1.00 0.00 O ATOM 608 OD2 ASP A 146 -11.733 2.898 -0.032 1.00 0.00 O ATOM 0 H ASP A 146 -8.113 6.722 -1.505 1.00 0.00 H new ATOM 0 HA ASP A 146 -9.715 6.166 0.800 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -11.008 5.197 -1.261 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -9.705 4.029 -1.364 1.00 0.00 H new ATOM 613 N VAL A 147 -8.013 4.293 1.469 1.00 0.00 N ATOM 614 CA VAL A 147 -6.905 3.549 2.097 1.00 0.00 C ATOM 615 C VAL A 147 -7.494 2.374 2.893 1.00 0.00 C ATOM 616 O VAL A 147 -8.541 2.527 3.521 1.00 0.00 O ATOM 617 CB VAL A 147 -6.063 4.438 3.054 1.00 0.00 C ATOM 618 CG1 VAL A 147 -4.848 3.671 3.600 1.00 0.00 C ATOM 619 CG2 VAL A 147 -5.528 5.735 2.425 1.00 0.00 C ATOM 0 H VAL A 147 -8.885 4.181 1.986 1.00 0.00 H new ATOM 0 HA VAL A 147 -6.242 3.200 1.305 1.00 0.00 H new ATOM 0 HB VAL A 147 -6.766 4.706 3.843 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -4.278 4.319 4.266 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -5.189 2.794 4.150 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -4.214 3.356 2.771 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -4.953 6.289 3.167 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -4.887 5.491 1.578 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -6.364 6.346 2.084 1.00 0.00 H new ATOM 629 N SER A 148 -6.836 1.210 2.894 1.00 0.00 N ATOM 630 CA SER A 148 -7.301 0.013 3.618 1.00 0.00 C ATOM 631 C SER A 148 -6.146 -0.927 4.012 1.00 0.00 C ATOM 632 O SER A 148 -5.357 -1.341 3.159 1.00 0.00 O ATOM 633 CB SER A 148 -8.328 -0.729 2.750 1.00 0.00 C ATOM 634 OG SER A 148 -8.983 -1.750 3.490 1.00 0.00 O ATOM 0 H SER A 148 -5.960 1.067 2.391 1.00 0.00 H new ATOM 0 HA SER A 148 -7.762 0.340 4.550 1.00 0.00 H new ATOM 0 HB2 SER A 148 -9.065 -0.022 2.369 1.00 0.00 H new ATOM 0 HB3 SER A 148 -7.829 -1.166 1.885 1.00 0.00 H new ATOM 0 HG SER A 148 -9.633 -2.206 2.915 1.00 0.00 H new ATOM 640 N ILE A 149 -6.029 -1.276 5.299 1.00 0.00 N ATOM 641 CA ILE A 149 -5.053 -2.250 5.833 1.00 0.00 C ATOM 642 C ILE A 149 -5.677 -3.655 5.876 1.00 0.00 C ATOM 643 O ILE A 149 -6.875 -3.801 6.121 1.00 0.00 O ATOM 644 CB ILE A 149 -4.545 -1.771 7.218 1.00 0.00 C ATOM 645 CG1 ILE A 149 -3.673 -0.512 7.022 1.00 0.00 C ATOM 646 CG2 ILE A 149 -3.751 -2.853 7.980 1.00 0.00 C ATOM 647 CD1 ILE A 149 -3.320 0.238 8.299 1.00 0.00 C ATOM 0 H ILE A 149 -6.626 -0.880 6.024 1.00 0.00 H new ATOM 0 HA ILE A 149 -4.186 -2.313 5.176 1.00 0.00 H new ATOM 0 HB ILE A 149 -5.419 -1.545 7.829 1.00 0.00 H new ATOM 0 HG12 ILE A 149 -2.748 -0.804 6.524 1.00 0.00 H new ATOM 0 HG13 ILE A 149 -4.195 0.171 6.351 1.00 0.00 H new ATOM 0 HG21 ILE A 149 -3.424 -2.455 8.941 1.00 0.00 H new ATOM 0 HG22 ILE A 149 -4.387 -3.723 8.145 1.00 0.00 H new ATOM 0 HG23 ILE A 149 -2.881 -3.146 7.393 1.00 0.00 H new ATOM 0 HD11 ILE A 149 -2.706 1.105 8.054 1.00 0.00 H new ATOM 0 HD12 ILE A 149 -4.235 0.568 8.792 1.00 0.00 H new ATOM 0 HD13 ILE A 149 -2.766 -0.422 8.967 1.00 0.00 H new ATOM 659 N VAL A 150 -4.867 -4.694 5.648 1.00 0.00 N ATOM 660 CA VAL A 150 -5.303 -6.097 5.734 1.00 0.00 C ATOM 661 C VAL A 150 -5.197 -6.579 7.185 1.00 0.00 C ATOM 662 O VAL A 150 -4.122 -6.552 7.786 1.00 0.00 O ATOM 663 CB VAL A 150 -4.511 -7.007 4.768 1.00 0.00 C ATOM 664 CG1 VAL A 150 -4.968 -8.473 4.889 1.00 0.00 C ATOM 665 CG2 VAL A 150 -4.721 -6.533 3.318 1.00 0.00 C ATOM 0 H VAL A 150 -3.884 -4.588 5.397 1.00 0.00 H new ATOM 0 HA VAL A 150 -6.346 -6.156 5.421 1.00 0.00 H new ATOM 0 HB VAL A 150 -3.456 -6.945 5.034 1.00 0.00 H new ATOM 0 HG11 VAL A 150 -4.394 -9.091 4.198 1.00 0.00 H new ATOM 0 HG12 VAL A 150 -4.805 -8.822 5.909 1.00 0.00 H new ATOM 0 HG13 VAL A 150 -6.028 -8.545 4.646 1.00 0.00 H new ATOM 0 HG21 VAL A 150 -4.161 -7.177 2.640 1.00 0.00 H new ATOM 0 HG22 VAL A 150 -5.781 -6.580 3.070 1.00 0.00 H new ATOM 0 HG23 VAL A 150 -4.369 -5.506 3.216 1.00 0.00 H new ATOM 675 N TYR A 151 -6.327 -7.039 7.728 1.00 0.00 N ATOM 676 CA TYR A 151 -6.472 -7.546 9.097 1.00 0.00 C ATOM 677 C TYR A 151 -6.881 -9.031 9.118 1.00 0.00 C ATOM 678 O TYR A 151 -7.583 -9.516 8.227 1.00 0.00 O ATOM 679 CB TYR A 151 -7.496 -6.692 9.862 1.00 0.00 C ATOM 680 CG TYR A 151 -7.112 -5.233 10.044 1.00 0.00 C ATOM 681 CD1 TYR A 151 -6.183 -4.861 11.035 1.00 0.00 C ATOM 682 CD2 TYR A 151 -7.703 -4.238 9.240 1.00 0.00 C ATOM 683 CE1 TYR A 151 -5.834 -3.509 11.215 1.00 0.00 C ATOM 684 CE2 TYR A 151 -7.367 -2.883 9.420 1.00 0.00 C ATOM 685 CZ TYR A 151 -6.427 -2.511 10.408 1.00 0.00 C ATOM 686 OH TYR A 151 -6.097 -1.201 10.590 1.00 0.00 O ATOM 0 H TYR A 151 -7.202 -7.070 7.205 1.00 0.00 H new ATOM 0 HA TYR A 151 -5.502 -7.473 9.588 1.00 0.00 H new ATOM 0 HB2 TYR A 151 -8.449 -6.738 9.336 1.00 0.00 H new ATOM 0 HB3 TYR A 151 -7.653 -7.135 10.845 1.00 0.00 H new ATOM 0 HD1 TYR A 151 -5.735 -5.618 11.661 1.00 0.00 H new ATOM 0 HD2 TYR A 151 -8.419 -4.517 8.481 1.00 0.00 H new ATOM 0 HE1 TYR A 151 -5.113 -3.234 11.970 1.00 0.00 H new ATOM 0 HE2 TYR A 151 -7.828 -2.126 8.802 1.00 0.00 H new ATOM 0 HH TYR A 151 -6.524 -0.657 9.896 1.00 0.00 H new ATOM 696 N ASP A 152 -6.438 -9.754 10.147 1.00 0.00 N ATOM 697 CA ASP A 152 -6.609 -11.199 10.304 1.00 0.00 C ATOM 698 C ASP A 152 -8.080 -11.651 10.402 1.00 0.00 C ATOM 699 O ASP A 152 -8.940 -10.943 10.922 1.00 0.00 O ATOM 700 CB ASP A 152 -5.784 -11.665 11.514 1.00 0.00 C ATOM 701 CG ASP A 152 -5.887 -13.181 11.697 1.00 0.00 C ATOM 702 OD1 ASP A 152 -5.218 -13.911 10.931 1.00 0.00 O ATOM 703 OD2 ASP A 152 -6.717 -13.612 12.528 1.00 0.00 O ATOM 0 H ASP A 152 -5.930 -9.333 10.925 1.00 0.00 H new ATOM 0 HA ASP A 152 -6.242 -11.677 9.396 1.00 0.00 H new ATOM 0 HB2 ASP A 152 -4.740 -11.382 11.378 1.00 0.00 H new ATOM 0 HB3 ASP A 152 -6.136 -11.162 12.414 1.00 0.00 H new ATOM 708 N GLN A 153 -8.358 -12.855 9.897 1.00 0.00 N ATOM 709 CA GLN A 153 -9.702 -13.415 9.722 1.00 0.00 C ATOM 710 C GLN A 153 -10.338 -13.960 11.019 1.00 0.00 C ATOM 711 O GLN A 153 -11.512 -14.335 10.995 1.00 0.00 O ATOM 712 CB GLN A 153 -9.621 -14.513 8.642 1.00 0.00 C ATOM 713 CG GLN A 153 -9.292 -13.956 7.244 1.00 0.00 C ATOM 714 CD GLN A 153 -8.793 -15.052 6.302 1.00 0.00 C ATOM 715 OE1 GLN A 153 -7.603 -15.339 6.233 1.00 0.00 O ATOM 716 NE2 GLN A 153 -9.657 -15.706 5.552 1.00 0.00 N ATOM 0 H GLN A 153 -7.625 -13.492 9.586 1.00 0.00 H new ATOM 0 HA GLN A 153 -10.363 -12.605 9.415 1.00 0.00 H new ATOM 0 HB2 GLN A 153 -8.860 -15.240 8.926 1.00 0.00 H new ATOM 0 HB3 GLN A 153 -10.571 -15.046 8.601 1.00 0.00 H new ATOM 0 HG2 GLN A 153 -10.181 -13.489 6.820 1.00 0.00 H new ATOM 0 HG3 GLN A 153 -8.534 -13.178 7.331 1.00 0.00 H new ATOM 0 HE21 GLN A 153 -10.650 -15.477 5.600 1.00 0.00 H new ATOM 0 HE22 GLN A 153 -9.333 -16.441 4.924 1.00 0.00 H new ATOM 725 N GLN A 154 -9.614 -13.995 12.147 1.00 0.00 N ATOM 726 CA GLN A 154 -10.120 -14.524 13.424 1.00 0.00 C ATOM 727 C GLN A 154 -9.700 -13.674 14.638 1.00 0.00 C ATOM 728 O GLN A 154 -10.511 -13.448 15.534 1.00 0.00 O ATOM 729 CB GLN A 154 -9.656 -15.986 13.562 1.00 0.00 C ATOM 730 CG GLN A 154 -10.269 -16.699 14.781 1.00 0.00 C ATOM 731 CD GLN A 154 -9.910 -18.188 14.848 1.00 0.00 C ATOM 732 OE1 GLN A 154 -8.813 -18.621 14.510 1.00 0.00 O ATOM 733 NE2 GLN A 154 -10.815 -19.039 15.290 1.00 0.00 N ATOM 0 H GLN A 154 -8.654 -13.655 12.200 1.00 0.00 H new ATOM 0 HA GLN A 154 -11.209 -14.479 13.412 1.00 0.00 H new ATOM 0 HB2 GLN A 154 -9.921 -16.533 12.657 1.00 0.00 H new ATOM 0 HB3 GLN A 154 -8.569 -16.010 13.642 1.00 0.00 H new ATOM 0 HG2 GLN A 154 -9.928 -16.207 15.692 1.00 0.00 H new ATOM 0 HG3 GLN A 154 -11.353 -16.594 14.749 1.00 0.00 H new ATOM 0 HE21 GLN A 154 -11.734 -18.703 15.577 1.00 0.00 H new ATOM 0 HE22 GLN A 154 -10.596 -20.034 15.345 1.00 0.00 H new ATOM 742 N SER A 155 -8.466 -13.164 14.672 1.00 0.00 N ATOM 743 CA SER A 155 -7.931 -12.350 15.781 1.00 0.00 C ATOM 744 C SER A 155 -7.881 -10.840 15.456 1.00 0.00 C ATOM 745 O SER A 155 -7.595 -10.016 16.327 1.00 0.00 O ATOM 746 CB SER A 155 -6.550 -12.910 16.162 1.00 0.00 C ATOM 747 OG SER A 155 -6.096 -12.441 17.426 1.00 0.00 O ATOM 0 H SER A 155 -7.793 -13.305 13.918 1.00 0.00 H new ATOM 0 HA SER A 155 -8.608 -12.423 16.632 1.00 0.00 H new ATOM 0 HB2 SER A 155 -6.596 -13.999 16.179 1.00 0.00 H new ATOM 0 HB3 SER A 155 -5.826 -12.633 15.395 1.00 0.00 H new ATOM 0 HG SER A 155 -5.217 -12.827 17.621 1.00 0.00 H new ATOM 753 N ARG A 156 -8.174 -10.453 14.203 1.00 0.00 N ATOM 754 CA ARG A 156 -8.297 -9.071 13.711 1.00 0.00 C ATOM 755 C ARG A 156 -7.034 -8.188 13.842 1.00 0.00 C ATOM 756 O ARG A 156 -7.106 -6.971 13.661 1.00 0.00 O ATOM 757 CB ARG A 156 -9.558 -8.415 14.315 1.00 0.00 C ATOM 758 CG ARG A 156 -10.354 -7.639 13.257 1.00 0.00 C ATOM 759 CD ARG A 156 -11.144 -8.566 12.321 1.00 0.00 C ATOM 760 NE ARG A 156 -11.640 -7.833 11.141 1.00 0.00 N ATOM 761 CZ ARG A 156 -11.265 -7.996 9.875 1.00 0.00 C ATOM 762 NH1 ARG A 156 -10.386 -8.904 9.506 1.00 0.00 N ATOM 763 NH2 ARG A 156 -11.782 -7.226 8.943 1.00 0.00 N ATOM 0 H ARG A 156 -8.341 -11.136 13.464 1.00 0.00 H new ATOM 0 HA ARG A 156 -8.409 -9.147 12.629 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -10.192 -9.183 14.757 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -9.267 -7.740 15.120 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -11.043 -6.956 13.754 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -9.670 -7.029 12.667 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -10.508 -9.391 12.000 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -11.984 -9.003 12.861 1.00 0.00 H new ATOM 0 HE ARG A 156 -12.350 -7.122 11.315 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -9.963 -9.517 10.203 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -10.128 -8.994 8.523 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -12.465 -6.511 9.193 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -11.500 -7.344 7.970 1.00 0.00 H new ATOM 777 N ARG A 157 -5.867 -8.787 14.115 1.00 0.00 N ATOM 778 CA ARG A 157 -4.556 -8.114 14.130 1.00 0.00 C ATOM 779 C ARG A 157 -4.147 -7.714 12.710 1.00 0.00 C ATOM 780 O ARG A 157 -4.606 -8.321 11.743 1.00 0.00 O ATOM 781 CB ARG A 157 -3.478 -9.029 14.753 1.00 0.00 C ATOM 782 CG ARG A 157 -3.907 -9.800 16.015 1.00 0.00 C ATOM 783 CD ARG A 157 -4.408 -8.919 17.166 1.00 0.00 C ATOM 784 NE ARG A 157 -5.118 -9.746 18.155 1.00 0.00 N ATOM 785 CZ ARG A 157 -5.334 -9.488 19.436 1.00 0.00 C ATOM 786 NH1 ARG A 157 -4.879 -8.402 20.026 1.00 0.00 N ATOM 787 NH2 ARG A 157 -6.031 -10.350 20.143 1.00 0.00 N ATOM 0 H ARG A 157 -5.804 -9.780 14.338 1.00 0.00 H new ATOM 0 HA ARG A 157 -4.642 -7.215 14.740 1.00 0.00 H new ATOM 0 HB2 ARG A 157 -3.159 -9.750 14.000 1.00 0.00 H new ATOM 0 HB3 ARG A 157 -2.608 -8.420 14.999 1.00 0.00 H new ATOM 0 HG2 ARG A 157 -4.695 -10.503 15.744 1.00 0.00 H new ATOM 0 HG3 ARG A 157 -3.061 -10.390 16.369 1.00 0.00 H new ATOM 0 HD2 ARG A 157 -3.568 -8.411 17.639 1.00 0.00 H new ATOM 0 HD3 ARG A 157 -5.073 -8.145 16.781 1.00 0.00 H new ATOM 0 HE ARG A 157 -5.491 -10.630 17.810 1.00 0.00 H new ATOM 0 HH11 ARG A 157 -4.337 -7.721 19.494 1.00 0.00 H new ATOM 0 HH12 ARG A 157 -5.068 -8.242 21.015 1.00 0.00 H new ATOM 0 HH21 ARG A 157 -6.393 -11.196 19.703 1.00 0.00 H new ATOM 0 HH22 ARG A 157 -6.210 -10.172 21.131 1.00 0.00 H new ATOM 801 N SER A 158 -3.284 -6.715 12.548 1.00 0.00 N ATOM 802 CA SER A 158 -2.718 -6.404 11.225 1.00 0.00 C ATOM 803 C SER A 158 -1.866 -7.574 10.696 1.00 0.00 C ATOM 804 O SER A 158 -1.149 -8.225 11.462 1.00 0.00 O ATOM 805 CB SER A 158 -1.885 -5.120 11.279 1.00 0.00 C ATOM 806 OG SER A 158 -1.317 -4.843 10.004 1.00 0.00 O ATOM 0 H SER A 158 -2.960 -6.109 13.302 1.00 0.00 H new ATOM 0 HA SER A 158 -3.549 -6.250 10.536 1.00 0.00 H new ATOM 0 HB2 SER A 158 -2.511 -4.286 11.594 1.00 0.00 H new ATOM 0 HB3 SER A 158 -1.094 -5.223 12.022 1.00 0.00 H new ATOM 0 HG SER A 158 -0.789 -4.019 10.053 1.00 0.00 H new ATOM 812 N ARG A 159 -1.928 -7.823 9.380 1.00 0.00 N ATOM 813 CA ARG A 159 -1.056 -8.776 8.675 1.00 0.00 C ATOM 814 C ARG A 159 0.198 -8.107 8.071 1.00 0.00 C ATOM 815 O ARG A 159 0.989 -8.777 7.405 1.00 0.00 O ATOM 816 CB ARG A 159 -1.870 -9.568 7.632 1.00 0.00 C ATOM 817 CG ARG A 159 -2.854 -10.540 8.310 1.00 0.00 C ATOM 818 CD ARG A 159 -3.495 -11.505 7.303 1.00 0.00 C ATOM 819 NE ARG A 159 -4.200 -12.602 7.991 1.00 0.00 N ATOM 820 CZ ARG A 159 -5.048 -13.466 7.447 1.00 0.00 C ATOM 821 NH1 ARG A 159 -5.386 -13.437 6.177 1.00 0.00 N ATOM 822 NH2 ARG A 159 -5.594 -14.399 8.191 1.00 0.00 N ATOM 0 H ARG A 159 -2.597 -7.360 8.764 1.00 0.00 H new ATOM 0 HA ARG A 159 -0.671 -9.484 9.409 1.00 0.00 H new ATOM 0 HB2 ARG A 159 -2.420 -8.876 6.995 1.00 0.00 H new ATOM 0 HB3 ARG A 159 -1.192 -10.126 6.986 1.00 0.00 H new ATOM 0 HG2 ARG A 159 -2.329 -11.111 9.076 1.00 0.00 H new ATOM 0 HG3 ARG A 159 -3.635 -9.972 8.815 1.00 0.00 H new ATOM 0 HD2 ARG A 159 -4.195 -10.961 6.669 1.00 0.00 H new ATOM 0 HD3 ARG A 159 -2.726 -11.917 6.649 1.00 0.00 H new ATOM 0 HE ARG A 159 -4.017 -12.708 8.989 1.00 0.00 H new ATOM 0 HH11 ARG A 159 -4.991 -12.727 5.560 1.00 0.00 H new ATOM 0 HH12 ARG A 159 -6.043 -14.125 5.808 1.00 0.00 H new ATOM 0 HH21 ARG A 159 -5.366 -14.458 9.183 1.00 0.00 H new ATOM 0 HH22 ARG A 159 -6.246 -15.065 7.777 1.00 0.00 H new ATOM 836 N GLY A 160 0.405 -6.801 8.302 1.00 0.00 N ATOM 837 CA GLY A 160 1.616 -6.064 7.898 1.00 0.00 C ATOM 838 C GLY A 160 1.594 -5.531 6.463 1.00 0.00 C ATOM 839 O GLY A 160 2.652 -5.185 5.936 1.00 0.00 O ATOM 0 H GLY A 160 -0.277 -6.215 8.784 1.00 0.00 H new ATOM 0 HA2 GLY A 160 1.759 -5.226 8.580 1.00 0.00 H new ATOM 0 HA3 GLY A 160 2.479 -6.720 8.014 1.00 0.00 H new ATOM 843 N PHE A 161 0.415 -5.440 5.832 1.00 0.00 N ATOM 844 CA PHE A 161 0.253 -4.890 4.483 1.00 0.00 C ATOM 845 C PHE A 161 -1.113 -4.222 4.259 1.00 0.00 C ATOM 846 O PHE A 161 -2.074 -4.423 5.011 1.00 0.00 O ATOM 847 CB PHE A 161 0.620 -5.931 3.409 1.00 0.00 C ATOM 848 CG PHE A 161 -0.368 -7.054 3.158 1.00 0.00 C ATOM 849 CD1 PHE A 161 -0.466 -8.130 4.061 1.00 0.00 C ATOM 850 CD2 PHE A 161 -1.123 -7.071 1.969 1.00 0.00 C ATOM 851 CE1 PHE A 161 -1.315 -9.215 3.779 1.00 0.00 C ATOM 852 CE2 PHE A 161 -1.956 -8.165 1.678 1.00 0.00 C ATOM 853 CZ PHE A 161 -2.055 -9.236 2.583 1.00 0.00 C ATOM 0 H PHE A 161 -0.462 -5.750 6.251 1.00 0.00 H new ATOM 0 HA PHE A 161 0.968 -4.074 4.381 1.00 0.00 H new ATOM 0 HB2 PHE A 161 0.776 -5.403 2.468 1.00 0.00 H new ATOM 0 HB3 PHE A 161 1.575 -6.378 3.686 1.00 0.00 H new ATOM 0 HD1 PHE A 161 0.113 -8.122 4.973 1.00 0.00 H new ATOM 0 HD2 PHE A 161 -1.062 -6.242 1.280 1.00 0.00 H new ATOM 0 HE1 PHE A 161 -1.399 -10.032 4.480 1.00 0.00 H new ATOM 0 HE2 PHE A 161 -2.521 -8.183 0.758 1.00 0.00 H new ATOM 0 HZ PHE A 161 -2.699 -10.074 2.360 1.00 0.00 H new ATOM 863 N ALA A 162 -1.175 -3.389 3.220 1.00 0.00 N ATOM 864 CA ALA A 162 -2.252 -2.445 2.946 1.00 0.00 C ATOM 865 C ALA A 162 -2.293 -2.009 1.473 1.00 0.00 C ATOM 866 O ALA A 162 -1.378 -2.300 0.697 1.00 0.00 O ATOM 867 CB ALA A 162 -2.008 -1.228 3.851 1.00 0.00 C ATOM 0 H ALA A 162 -0.439 -3.355 2.515 1.00 0.00 H new ATOM 0 HA ALA A 162 -3.213 -2.918 3.146 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -2.790 -0.488 3.684 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -2.022 -1.542 4.895 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -1.038 -0.790 3.617 1.00 0.00 H new ATOM 873 N PHE A 163 -3.329 -1.249 1.120 1.00 0.00 N ATOM 874 CA PHE A 163 -3.557 -0.673 -0.202 1.00 0.00 C ATOM 875 C PHE A 163 -3.966 0.802 -0.081 1.00 0.00 C ATOM 876 O PHE A 163 -4.698 1.175 0.837 1.00 0.00 O ATOM 877 CB PHE A 163 -4.613 -1.507 -0.943 1.00 0.00 C ATOM 878 CG PHE A 163 -4.150 -2.920 -1.252 1.00 0.00 C ATOM 879 CD1 PHE A 163 -3.376 -3.166 -2.401 1.00 0.00 C ATOM 880 CD2 PHE A 163 -4.449 -3.979 -0.372 1.00 0.00 C ATOM 881 CE1 PHE A 163 -2.901 -4.461 -2.671 1.00 0.00 C ATOM 882 CE2 PHE A 163 -3.970 -5.274 -0.639 1.00 0.00 C ATOM 883 CZ PHE A 163 -3.195 -5.516 -1.789 1.00 0.00 C ATOM 0 H PHE A 163 -4.067 -1.007 1.781 1.00 0.00 H new ATOM 0 HA PHE A 163 -2.635 -0.700 -0.782 1.00 0.00 H new ATOM 0 HB2 PHE A 163 -5.520 -1.552 -0.340 1.00 0.00 H new ATOM 0 HB3 PHE A 163 -4.875 -1.005 -1.875 1.00 0.00 H new ATOM 0 HD1 PHE A 163 -3.146 -2.357 -3.078 1.00 0.00 H new ATOM 0 HD2 PHE A 163 -5.047 -3.796 0.509 1.00 0.00 H new ATOM 0 HE1 PHE A 163 -2.310 -4.646 -3.556 1.00 0.00 H new ATOM 0 HE2 PHE A 163 -4.197 -6.084 0.039 1.00 0.00 H new ATOM 0 HZ PHE A 163 -2.827 -6.510 -1.994 1.00 0.00 H new ATOM 893 N VAL A 164 -3.469 1.626 -1.005 1.00 0.00 N ATOM 894 CA VAL A 164 -3.608 3.094 -1.027 1.00 0.00 C ATOM 895 C VAL A 164 -4.101 3.518 -2.412 1.00 0.00 C ATOM 896 O VAL A 164 -3.459 3.216 -3.416 1.00 0.00 O ATOM 897 CB VAL A 164 -2.259 3.789 -0.708 1.00 0.00 C ATOM 898 CG1 VAL A 164 -2.390 5.321 -0.749 1.00 0.00 C ATOM 899 CG2 VAL A 164 -1.705 3.392 0.672 1.00 0.00 C ATOM 0 H VAL A 164 -2.932 1.277 -1.799 1.00 0.00 H new ATOM 0 HA VAL A 164 -4.325 3.395 -0.263 1.00 0.00 H new ATOM 0 HB VAL A 164 -1.567 3.452 -1.480 1.00 0.00 H new ATOM 0 HG11 VAL A 164 -1.426 5.775 -0.521 1.00 0.00 H new ATOM 0 HG12 VAL A 164 -2.711 5.632 -1.743 1.00 0.00 H new ATOM 0 HG13 VAL A 164 -3.126 5.643 -0.012 1.00 0.00 H new ATOM 0 HG21 VAL A 164 -0.760 3.906 0.846 1.00 0.00 H new ATOM 0 HG22 VAL A 164 -2.419 3.674 1.446 1.00 0.00 H new ATOM 0 HG23 VAL A 164 -1.543 2.315 0.703 1.00 0.00 H new ATOM 909 N TYR A 165 -5.239 4.211 -2.473 1.00 0.00 N ATOM 910 CA TYR A 165 -5.942 4.564 -3.712 1.00 0.00 C ATOM 911 C TYR A 165 -5.802 6.063 -4.015 1.00 0.00 C ATOM 912 O TYR A 165 -6.492 6.896 -3.423 1.00 0.00 O ATOM 913 CB TYR A 165 -7.424 4.157 -3.595 1.00 0.00 C ATOM 914 CG TYR A 165 -7.679 2.676 -3.366 1.00 0.00 C ATOM 915 CD1 TYR A 165 -7.556 2.123 -2.076 1.00 0.00 C ATOM 916 CD2 TYR A 165 -8.058 1.851 -4.444 1.00 0.00 C ATOM 917 CE1 TYR A 165 -7.769 0.748 -1.865 1.00 0.00 C ATOM 918 CE2 TYR A 165 -8.286 0.476 -4.239 1.00 0.00 C ATOM 919 CZ TYR A 165 -8.130 -0.083 -2.949 1.00 0.00 C ATOM 920 OH TYR A 165 -8.334 -1.415 -2.744 1.00 0.00 O ATOM 0 H TYR A 165 -5.713 4.554 -1.637 1.00 0.00 H new ATOM 0 HA TYR A 165 -5.492 4.022 -4.543 1.00 0.00 H new ATOM 0 HB2 TYR A 165 -7.873 4.716 -2.774 1.00 0.00 H new ATOM 0 HB3 TYR A 165 -7.939 4.460 -4.507 1.00 0.00 H new ATOM 0 HD1 TYR A 165 -7.296 2.759 -1.243 1.00 0.00 H new ATOM 0 HD2 TYR A 165 -8.174 2.274 -5.431 1.00 0.00 H new ATOM 0 HE1 TYR A 165 -7.657 0.329 -0.876 1.00 0.00 H new ATOM 0 HE2 TYR A 165 -8.580 -0.152 -5.067 1.00 0.00 H new ATOM 0 HH TYR A 165 -8.577 -1.843 -3.591 1.00 0.00 H new ATOM 930 N PHE A 166 -4.927 6.423 -4.956 1.00 0.00 N ATOM 931 CA PHE A 166 -4.777 7.795 -5.443 1.00 0.00 C ATOM 932 C PHE A 166 -5.921 8.173 -6.397 1.00 0.00 C ATOM 933 O PHE A 166 -6.547 7.309 -7.012 1.00 0.00 O ATOM 934 CB PHE A 166 -3.399 7.970 -6.098 1.00 0.00 C ATOM 935 CG PHE A 166 -2.259 7.931 -5.098 1.00 0.00 C ATOM 936 CD1 PHE A 166 -1.711 6.699 -4.688 1.00 0.00 C ATOM 937 CD2 PHE A 166 -1.785 9.130 -4.532 1.00 0.00 C ATOM 938 CE1 PHE A 166 -0.707 6.670 -3.705 1.00 0.00 C ATOM 939 CE2 PHE A 166 -0.772 9.101 -3.559 1.00 0.00 C ATOM 940 CZ PHE A 166 -0.241 7.870 -3.139 1.00 0.00 C ATOM 0 H PHE A 166 -4.295 5.761 -5.407 1.00 0.00 H new ATOM 0 HA PHE A 166 -4.837 8.479 -4.597 1.00 0.00 H new ATOM 0 HB2 PHE A 166 -3.252 7.184 -6.839 1.00 0.00 H new ATOM 0 HB3 PHE A 166 -3.374 8.920 -6.632 1.00 0.00 H new ATOM 0 HD1 PHE A 166 -2.062 5.778 -5.129 1.00 0.00 H new ATOM 0 HD2 PHE A 166 -2.202 10.075 -4.847 1.00 0.00 H new ATOM 0 HE1 PHE A 166 -0.293 5.725 -3.384 1.00 0.00 H new ATOM 0 HE2 PHE A 166 -0.402 10.023 -3.135 1.00 0.00 H new ATOM 0 HZ PHE A 166 0.527 7.845 -2.380 1.00 0.00 H new ATOM 950 N GLU A 167 -6.181 9.474 -6.539 1.00 0.00 N ATOM 951 CA GLU A 167 -7.198 9.994 -7.467 1.00 0.00 C ATOM 952 C GLU A 167 -6.744 9.933 -8.948 1.00 0.00 C ATOM 953 O GLU A 167 -7.548 10.131 -9.861 1.00 0.00 O ATOM 954 CB GLU A 167 -7.585 11.414 -7.022 1.00 0.00 C ATOM 955 CG GLU A 167 -8.884 11.925 -7.656 1.00 0.00 C ATOM 956 CD GLU A 167 -9.354 13.226 -6.989 1.00 0.00 C ATOM 957 OE1 GLU A 167 -8.922 14.323 -7.418 1.00 0.00 O ATOM 958 OE2 GLU A 167 -10.173 13.162 -6.042 1.00 0.00 O ATOM 0 H GLU A 167 -5.694 10.201 -6.015 1.00 0.00 H new ATOM 0 HA GLU A 167 -8.080 9.355 -7.424 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -7.690 11.430 -5.937 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -6.774 12.098 -7.274 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -8.729 12.095 -8.721 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -9.660 11.165 -7.564 1.00 0.00 H new ATOM 965 N ASN A 168 -5.469 9.610 -9.201 1.00 0.00 N ATOM 966 CA ASN A 168 -4.861 9.502 -10.530 1.00 0.00 C ATOM 967 C ASN A 168 -3.676 8.514 -10.523 1.00 0.00 C ATOM 968 O ASN A 168 -2.906 8.468 -9.560 1.00 0.00 O ATOM 969 CB ASN A 168 -4.403 10.907 -10.981 1.00 0.00 C ATOM 970 CG ASN A 168 -4.182 11.045 -12.486 1.00 0.00 C ATOM 971 OD1 ASN A 168 -3.837 10.097 -13.181 1.00 0.00 O ATOM 972 ND2 ASN A 168 -4.366 12.230 -13.036 1.00 0.00 N ATOM 0 H ASN A 168 -4.806 9.409 -8.452 1.00 0.00 H new ATOM 0 HA ASN A 168 -5.598 9.113 -11.233 1.00 0.00 H new ATOM 0 HB2 ASN A 168 -5.149 11.637 -10.667 1.00 0.00 H new ATOM 0 HB3 ASN A 168 -3.476 11.157 -10.465 1.00 0.00 H new ATOM 0 HD21 ASN A 168 -4.221 12.355 -14.038 1.00 0.00 H new ATOM 0 HD22 ASN A 168 -4.653 13.021 -12.459 1.00 0.00 H new ATOM 979 N VAL A 169 -3.486 7.773 -11.617 1.00 0.00 N ATOM 980 CA VAL A 169 -2.288 6.946 -11.857 1.00 0.00 C ATOM 981 C VAL A 169 -1.009 7.797 -11.934 1.00 0.00 C ATOM 982 O VAL A 169 0.062 7.313 -11.591 1.00 0.00 O ATOM 983 CB VAL A 169 -2.453 6.049 -13.109 1.00 0.00 C ATOM 984 CG1 VAL A 169 -2.632 6.841 -14.415 1.00 0.00 C ATOM 985 CG2 VAL A 169 -1.291 5.057 -13.272 1.00 0.00 C ATOM 0 H VAL A 169 -4.166 7.726 -12.375 1.00 0.00 H new ATOM 0 HA VAL A 169 -2.180 6.285 -10.997 1.00 0.00 H new ATOM 0 HB VAL A 169 -3.374 5.495 -12.927 1.00 0.00 H new ATOM 0 HG11 VAL A 169 -2.741 6.148 -15.249 1.00 0.00 H new ATOM 0 HG12 VAL A 169 -3.523 7.465 -14.343 1.00 0.00 H new ATOM 0 HG13 VAL A 169 -1.759 7.472 -14.580 1.00 0.00 H new ATOM 0 HG21 VAL A 169 -1.452 4.451 -14.163 1.00 0.00 H new ATOM 0 HG22 VAL A 169 -0.355 5.606 -13.371 1.00 0.00 H new ATOM 0 HG23 VAL A 169 -1.240 4.409 -12.397 1.00 0.00 H new ATOM 995 N ASP A 170 -1.114 9.078 -12.306 1.00 0.00 N ATOM 996 CA ASP A 170 0.014 10.020 -12.301 1.00 0.00 C ATOM 997 C ASP A 170 0.514 10.357 -10.879 1.00 0.00 C ATOM 998 O ASP A 170 1.718 10.512 -10.668 1.00 0.00 O ATOM 999 CB ASP A 170 -0.404 11.289 -13.056 1.00 0.00 C ATOM 1000 CG ASP A 170 0.777 12.251 -13.273 1.00 0.00 C ATOM 1001 OD1 ASP A 170 1.697 11.902 -14.051 1.00 0.00 O ATOM 1002 OD2 ASP A 170 0.762 13.365 -12.697 1.00 0.00 O ATOM 0 H ASP A 170 -1.990 9.494 -12.621 1.00 0.00 H new ATOM 0 HA ASP A 170 0.857 9.544 -12.802 1.00 0.00 H new ATOM 0 HB2 ASP A 170 -0.827 11.012 -14.022 1.00 0.00 H new ATOM 0 HB3 ASP A 170 -1.189 11.800 -12.498 1.00 0.00 H new ATOM 1007 N ASP A 171 -0.386 10.397 -9.888 1.00 0.00 N ATOM 1008 CA ASP A 171 -0.022 10.571 -8.474 1.00 0.00 C ATOM 1009 C ASP A 171 0.482 9.255 -7.854 1.00 0.00 C ATOM 1010 O ASP A 171 1.432 9.265 -7.068 1.00 0.00 O ATOM 1011 CB ASP A 171 -1.214 11.128 -7.682 1.00 0.00 C ATOM 1012 CG ASP A 171 -1.643 12.534 -8.137 1.00 0.00 C ATOM 1013 OD1 ASP A 171 -0.806 13.467 -8.119 1.00 0.00 O ATOM 1014 OD2 ASP A 171 -2.836 12.707 -8.476 1.00 0.00 O ATOM 0 H ASP A 171 -1.390 10.309 -10.044 1.00 0.00 H new ATOM 0 HA ASP A 171 0.797 11.289 -8.423 1.00 0.00 H new ATOM 0 HB2 ASP A 171 -2.059 10.447 -7.784 1.00 0.00 H new ATOM 0 HB3 ASP A 171 -0.955 11.159 -6.624 1.00 0.00 H new ATOM 1019 N ALA A 172 -0.085 8.112 -8.267 1.00 0.00 N ATOM 1020 CA ALA A 172 0.400 6.784 -7.885 1.00 0.00 C ATOM 1021 C ALA A 172 1.818 6.505 -8.421 1.00 0.00 C ATOM 1022 O ALA A 172 2.644 5.937 -7.711 1.00 0.00 O ATOM 1023 CB ALA A 172 -0.610 5.736 -8.368 1.00 0.00 C ATOM 0 H ALA A 172 -0.900 8.087 -8.880 1.00 0.00 H new ATOM 0 HA ALA A 172 0.482 6.734 -6.799 1.00 0.00 H new ATOM 0 HB1 ALA A 172 -0.262 4.741 -8.091 1.00 0.00 H new ATOM 0 HB2 ALA A 172 -1.579 5.924 -7.905 1.00 0.00 H new ATOM 0 HB3 ALA A 172 -0.708 5.797 -9.452 1.00 0.00 H new ATOM 1029 N LYS A 173 2.148 6.967 -9.634 1.00 0.00 N ATOM 1030 CA LYS A 173 3.510 6.919 -10.183 1.00 0.00 C ATOM 1031 C LYS A 173 4.500 7.698 -9.303 1.00 0.00 C ATOM 1032 O LYS A 173 5.535 7.147 -8.921 1.00 0.00 O ATOM 1033 CB LYS A 173 3.508 7.452 -11.630 1.00 0.00 C ATOM 1034 CG LYS A 173 3.038 6.406 -12.654 1.00 0.00 C ATOM 1035 CD LYS A 173 2.815 7.051 -14.028 1.00 0.00 C ATOM 1036 CE LYS A 173 2.401 5.992 -15.057 1.00 0.00 C ATOM 1037 NZ LYS A 173 2.203 6.585 -16.407 1.00 0.00 N ATOM 0 H LYS A 173 1.470 7.389 -10.269 1.00 0.00 H new ATOM 0 HA LYS A 173 3.843 5.881 -10.192 1.00 0.00 H new ATOM 0 HB2 LYS A 173 2.860 8.327 -11.688 1.00 0.00 H new ATOM 0 HB3 LYS A 173 4.513 7.782 -11.891 1.00 0.00 H new ATOM 0 HG2 LYS A 173 3.780 5.612 -12.736 1.00 0.00 H new ATOM 0 HG3 LYS A 173 2.113 5.944 -12.310 1.00 0.00 H new ATOM 0 HD2 LYS A 173 2.043 7.818 -13.956 1.00 0.00 H new ATOM 0 HD3 LYS A 173 3.728 7.548 -14.356 1.00 0.00 H new ATOM 0 HE2 LYS A 173 3.165 5.216 -15.109 1.00 0.00 H new ATOM 0 HE3 LYS A 173 1.479 5.510 -14.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 173 1.924 5.839 -17.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 173 1.456 7.308 -16.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 173 3.090 7.023 -16.727 1.00 0.00 H new ATOM 1051 N GLU A 174 4.174 8.942 -8.932 1.00 0.00 N ATOM 1052 CA GLU A 174 5.007 9.765 -8.063 1.00 0.00 C ATOM 1053 C GLU A 174 5.234 9.097 -6.698 1.00 0.00 C ATOM 1054 O GLU A 174 6.376 8.970 -6.255 1.00 0.00 O ATOM 1055 CB GLU A 174 4.361 11.152 -7.912 1.00 0.00 C ATOM 1056 CG GLU A 174 5.391 12.145 -7.380 1.00 0.00 C ATOM 1057 CD GLU A 174 4.833 13.574 -7.287 1.00 0.00 C ATOM 1058 OE1 GLU A 174 4.671 14.232 -8.343 1.00 0.00 O ATOM 1059 OE2 GLU A 174 4.598 14.062 -6.158 1.00 0.00 O ATOM 0 H GLU A 174 3.316 9.405 -9.232 1.00 0.00 H new ATOM 0 HA GLU A 174 5.991 9.878 -8.518 1.00 0.00 H new ATOM 0 HB2 GLU A 174 3.977 11.492 -8.874 1.00 0.00 H new ATOM 0 HB3 GLU A 174 3.511 11.096 -7.232 1.00 0.00 H new ATOM 0 HG2 GLU A 174 5.726 11.824 -6.394 1.00 0.00 H new ATOM 0 HG3 GLU A 174 6.266 12.141 -8.031 1.00 0.00 H new ATOM 1066 N ALA A 175 4.171 8.595 -6.065 1.00 0.00 N ATOM 1067 CA ALA A 175 4.260 7.897 -4.784 1.00 0.00 C ATOM 1068 C ALA A 175 5.121 6.626 -4.859 1.00 0.00 C ATOM 1069 O ALA A 175 6.016 6.451 -4.034 1.00 0.00 O ATOM 1070 CB ALA A 175 2.837 7.595 -4.310 1.00 0.00 C ATOM 0 H ALA A 175 3.221 8.663 -6.430 1.00 0.00 H new ATOM 0 HA ALA A 175 4.765 8.538 -4.062 1.00 0.00 H new ATOM 0 HB1 ALA A 175 2.875 7.073 -3.354 1.00 0.00 H new ATOM 0 HB2 ALA A 175 2.287 8.529 -4.192 1.00 0.00 H new ATOM 0 HB3 ALA A 175 2.334 6.968 -5.046 1.00 0.00 H new ATOM 1076 N LYS A 176 4.923 5.764 -5.861 1.00 0.00 N ATOM 1077 CA LYS A 176 5.702 4.527 -6.018 1.00 0.00 C ATOM 1078 C LYS A 176 7.203 4.808 -6.216 1.00 0.00 C ATOM 1079 O LYS A 176 8.036 4.130 -5.614 1.00 0.00 O ATOM 1080 CB LYS A 176 5.074 3.692 -7.154 1.00 0.00 C ATOM 1081 CG LYS A 176 5.529 2.219 -7.196 1.00 0.00 C ATOM 1082 CD LYS A 176 6.813 1.938 -7.995 1.00 0.00 C ATOM 1083 CE LYS A 176 6.592 2.089 -9.505 1.00 0.00 C ATOM 1084 NZ LYS A 176 7.859 1.930 -10.264 1.00 0.00 N ATOM 0 H LYS A 176 4.219 5.902 -6.587 1.00 0.00 H new ATOM 0 HA LYS A 176 5.656 3.942 -5.100 1.00 0.00 H new ATOM 0 HB2 LYS A 176 3.989 3.721 -7.051 1.00 0.00 H new ATOM 0 HB3 LYS A 176 5.316 4.161 -8.108 1.00 0.00 H new ATOM 0 HG2 LYS A 176 5.678 1.875 -6.172 1.00 0.00 H new ATOM 0 HG3 LYS A 176 4.722 1.621 -7.619 1.00 0.00 H new ATOM 0 HD2 LYS A 176 7.598 2.622 -7.673 1.00 0.00 H new ATOM 0 HD3 LYS A 176 7.162 0.928 -7.778 1.00 0.00 H new ATOM 0 HE2 LYS A 176 5.869 1.346 -9.843 1.00 0.00 H new ATOM 0 HE3 LYS A 176 6.163 3.069 -9.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 7.658 1.954 -11.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 8.509 2.705 -10.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 8.299 1.020 -10.019 1.00 0.00 H new ATOM 1098 N GLU A 177 7.556 5.839 -6.990 1.00 0.00 N ATOM 1099 CA GLU A 177 8.951 6.213 -7.279 1.00 0.00 C ATOM 1100 C GLU A 177 9.676 6.894 -6.105 1.00 0.00 C ATOM 1101 O GLU A 177 10.902 7.033 -6.147 1.00 0.00 O ATOM 1102 CB GLU A 177 8.996 7.126 -8.516 1.00 0.00 C ATOM 1103 CG GLU A 177 8.600 6.397 -9.804 1.00 0.00 C ATOM 1104 CD GLU A 177 9.653 5.366 -10.229 1.00 0.00 C ATOM 1105 OE1 GLU A 177 10.664 5.749 -10.864 1.00 0.00 O ATOM 1106 OE2 GLU A 177 9.460 4.162 -9.939 1.00 0.00 O ATOM 0 H GLU A 177 6.874 6.448 -7.442 1.00 0.00 H new ATOM 0 HA GLU A 177 9.484 5.280 -7.464 1.00 0.00 H new ATOM 0 HB2 GLU A 177 8.327 7.973 -8.362 1.00 0.00 H new ATOM 0 HB3 GLU A 177 10.002 7.531 -8.627 1.00 0.00 H new ATOM 0 HG2 GLU A 177 7.642 5.898 -9.658 1.00 0.00 H new ATOM 0 HG3 GLU A 177 8.461 7.124 -10.604 1.00 0.00 H new ATOM 1113 N ARG A 178 8.948 7.325 -5.068 1.00 0.00 N ATOM 1114 CA ARG A 178 9.496 8.006 -3.882 1.00 0.00 C ATOM 1115 C ARG A 178 9.380 7.205 -2.574 1.00 0.00 C ATOM 1116 O ARG A 178 10.293 7.269 -1.748 1.00 0.00 O ATOM 1117 CB ARG A 178 8.796 9.365 -3.725 1.00 0.00 C ATOM 1118 CG ARG A 178 8.986 10.362 -4.885 1.00 0.00 C ATOM 1119 CD ARG A 178 10.419 10.870 -5.060 1.00 0.00 C ATOM 1120 NE ARG A 178 11.281 9.871 -5.712 1.00 0.00 N ATOM 1121 CZ ARG A 178 12.512 10.027 -6.172 1.00 0.00 C ATOM 1122 NH1 ARG A 178 13.141 11.184 -6.138 1.00 0.00 N ATOM 1123 NH2 ARG A 178 13.121 8.979 -6.679 1.00 0.00 N ATOM 0 H ARG A 178 7.936 7.208 -5.026 1.00 0.00 H new ATOM 0 HA ARG A 178 10.566 8.123 -4.057 1.00 0.00 H new ATOM 0 HB2 ARG A 178 7.728 9.188 -3.596 1.00 0.00 H new ATOM 0 HB3 ARG A 178 9.155 9.832 -2.808 1.00 0.00 H new ATOM 0 HG2 ARG A 178 8.668 9.885 -5.812 1.00 0.00 H new ATOM 0 HG3 ARG A 178 8.329 11.216 -4.724 1.00 0.00 H new ATOM 0 HD2 ARG A 178 10.410 11.784 -5.654 1.00 0.00 H new ATOM 0 HD3 ARG A 178 10.834 11.127 -4.086 1.00 0.00 H new ATOM 0 HE ARG A 178 10.879 8.940 -5.823 1.00 0.00 H new ATOM 0 HH11 ARG A 178 12.679 12.004 -5.746 1.00 0.00 H new ATOM 0 HH12 ARG A 178 14.090 11.259 -6.504 1.00 0.00 H new ATOM 0 HH21 ARG A 178 12.645 8.078 -6.710 1.00 0.00 H new ATOM 0 HH22 ARG A 178 14.070 9.067 -7.042 1.00 0.00 H new ATOM 1137 N ALA A 179 8.305 6.439 -2.379 1.00 0.00 N ATOM 1138 CA ALA A 179 8.041 5.695 -1.143 1.00 0.00 C ATOM 1139 C ALA A 179 8.606 4.264 -1.137 1.00 0.00 C ATOM 1140 O ALA A 179 8.812 3.701 -0.062 1.00 0.00 O ATOM 1141 CB ALA A 179 6.526 5.694 -0.895 1.00 0.00 C ATOM 0 H ALA A 179 7.581 6.315 -3.086 1.00 0.00 H new ATOM 0 HA ALA A 179 8.567 6.201 -0.333 1.00 0.00 H new ATOM 0 HB1 ALA A 179 6.308 5.145 0.021 1.00 0.00 H new ATOM 0 HB2 ALA A 179 6.173 6.720 -0.796 1.00 0.00 H new ATOM 0 HB3 ALA A 179 6.020 5.216 -1.734 1.00 0.00 H new ATOM 1147 N ASN A 180 8.882 3.655 -2.296 1.00 0.00 N ATOM 1148 CA ASN A 180 9.348 2.265 -2.341 1.00 0.00 C ATOM 1149 C ASN A 180 10.714 2.086 -1.647 1.00 0.00 C ATOM 1150 O ASN A 180 11.735 2.605 -2.105 1.00 0.00 O ATOM 1151 CB ASN A 180 9.369 1.744 -3.787 1.00 0.00 C ATOM 1152 CG ASN A 180 9.712 0.257 -3.831 1.00 0.00 C ATOM 1153 OD1 ASN A 180 9.275 -0.521 -2.988 1.00 0.00 O ATOM 1154 ND2 ASN A 180 10.511 -0.178 -4.786 1.00 0.00 N ATOM 0 H ASN A 180 8.791 4.100 -3.210 1.00 0.00 H new ATOM 0 HA ASN A 180 8.636 1.662 -1.778 1.00 0.00 H new ATOM 0 HB2 ASN A 180 8.397 1.910 -4.251 1.00 0.00 H new ATOM 0 HB3 ASN A 180 10.100 2.306 -4.369 1.00 0.00 H new ATOM 0 HD21 ASN A 180 10.768 -1.164 -4.826 1.00 0.00 H new ATOM 0 HD22 ASN A 180 10.872 0.472 -5.484 1.00 0.00 H new ATOM 1161 N GLY A 181 10.719 1.335 -0.540 1.00 0.00 N ATOM 1162 CA GLY A 181 11.913 0.951 0.220 1.00 0.00 C ATOM 1163 C GLY A 181 12.284 1.870 1.387 1.00 0.00 C ATOM 1164 O GLY A 181 13.260 1.573 2.079 1.00 0.00 O ATOM 0 H GLY A 181 9.860 0.964 -0.134 1.00 0.00 H new ATOM 0 HA2 GLY A 181 11.765 -0.057 0.609 1.00 0.00 H new ATOM 0 HA3 GLY A 181 12.759 0.907 -0.466 1.00 0.00 H new ATOM 1168 N MET A 182 11.540 2.956 1.636 1.00 0.00 N ATOM 1169 CA MET A 182 11.728 3.811 2.825 1.00 0.00 C ATOM 1170 C MET A 182 11.419 3.101 4.167 1.00 0.00 C ATOM 1171 O MET A 182 11.179 1.890 4.221 1.00 0.00 O ATOM 1172 CB MET A 182 10.939 5.124 2.640 1.00 0.00 C ATOM 1173 CG MET A 182 9.438 4.989 2.921 1.00 0.00 C ATOM 1174 SD MET A 182 8.517 6.510 2.613 1.00 0.00 S ATOM 1175 CE MET A 182 6.922 5.968 3.262 1.00 0.00 C ATOM 0 H MET A 182 10.789 3.270 1.021 1.00 0.00 H new ATOM 0 HA MET A 182 12.790 4.047 2.900 1.00 0.00 H new ATOM 0 HB2 MET A 182 11.356 5.884 3.301 1.00 0.00 H new ATOM 0 HB3 MET A 182 11.077 5.479 1.619 1.00 0.00 H new ATOM 0 HG2 MET A 182 9.029 4.192 2.300 1.00 0.00 H new ATOM 0 HG3 MET A 182 9.295 4.689 3.959 1.00 0.00 H new ATOM 0 HE1 MET A 182 6.128 6.277 2.582 1.00 0.00 H new ATOM 0 HE2 MET A 182 6.917 4.882 3.355 1.00 0.00 H new ATOM 0 HE3 MET A 182 6.756 6.417 4.241 1.00 0.00 H new ATOM 1185 N GLU A 183 11.406 3.860 5.265 1.00 0.00 N ATOM 1186 CA GLU A 183 11.075 3.389 6.612 1.00 0.00 C ATOM 1187 C GLU A 183 9.857 4.146 7.172 1.00 0.00 C ATOM 1188 O GLU A 183 9.811 5.378 7.130 1.00 0.00 O ATOM 1189 CB GLU A 183 12.308 3.568 7.514 1.00 0.00 C ATOM 1190 CG GLU A 183 12.173 2.832 8.852 1.00 0.00 C ATOM 1191 CD GLU A 183 13.461 2.973 9.675 1.00 0.00 C ATOM 1192 OE1 GLU A 183 14.384 2.143 9.499 1.00 0.00 O ATOM 1193 OE2 GLU A 183 13.558 3.912 10.499 1.00 0.00 O ATOM 0 H GLU A 183 11.634 4.854 5.240 1.00 0.00 H new ATOM 0 HA GLU A 183 10.806 2.333 6.577 1.00 0.00 H new ATOM 0 HB2 GLU A 183 13.192 3.203 6.991 1.00 0.00 H new ATOM 0 HB3 GLU A 183 12.464 4.630 7.702 1.00 0.00 H new ATOM 0 HG2 GLU A 183 11.330 3.236 9.413 1.00 0.00 H new ATOM 0 HG3 GLU A 183 11.962 1.778 8.674 1.00 0.00 H new ATOM 1200 N LEU A 184 8.890 3.405 7.726 1.00 0.00 N ATOM 1201 CA LEU A 184 7.730 3.925 8.461 1.00 0.00 C ATOM 1202 C LEU A 184 7.602 3.176 9.799 1.00 0.00 C ATOM 1203 O LEU A 184 7.555 1.948 9.827 1.00 0.00 O ATOM 1204 CB LEU A 184 6.471 3.803 7.569 1.00 0.00 C ATOM 1205 CG LEU A 184 5.134 4.115 8.276 1.00 0.00 C ATOM 1206 CD1 LEU A 184 5.115 5.527 8.879 1.00 0.00 C ATOM 1207 CD2 LEU A 184 3.978 3.971 7.273 1.00 0.00 C ATOM 0 H LEU A 184 8.894 2.386 7.673 1.00 0.00 H new ATOM 0 HA LEU A 184 7.853 4.982 8.699 1.00 0.00 H new ATOM 0 HB2 LEU A 184 6.580 4.477 6.719 1.00 0.00 H new ATOM 0 HB3 LEU A 184 6.425 2.790 7.169 1.00 0.00 H new ATOM 0 HG LEU A 184 5.018 3.404 9.094 1.00 0.00 H new ATOM 0 HD11 LEU A 184 4.156 5.702 9.366 1.00 0.00 H new ATOM 0 HD12 LEU A 184 5.916 5.620 9.612 1.00 0.00 H new ATOM 0 HD13 LEU A 184 5.260 6.263 8.088 1.00 0.00 H new ATOM 0 HD21 LEU A 184 3.034 4.191 7.772 1.00 0.00 H new ATOM 0 HD22 LEU A 184 4.124 4.668 6.448 1.00 0.00 H new ATOM 0 HD23 LEU A 184 3.956 2.952 6.888 1.00 0.00 H new ATOM 1219 N ASP A 185 7.585 3.921 10.909 1.00 0.00 N ATOM 1220 CA ASP A 185 7.440 3.421 12.292 1.00 0.00 C ATOM 1221 C ASP A 185 8.556 2.430 12.708 1.00 0.00 C ATOM 1222 O ASP A 185 8.348 1.523 13.516 1.00 0.00 O ATOM 1223 CB ASP A 185 6.009 2.886 12.515 1.00 0.00 C ATOM 1224 CG ASP A 185 5.658 2.715 14.006 1.00 0.00 C ATOM 1225 OD1 ASP A 185 5.850 3.680 14.785 1.00 0.00 O ATOM 1226 OD2 ASP A 185 5.149 1.634 14.390 1.00 0.00 O ATOM 0 H ASP A 185 7.676 4.936 10.873 1.00 0.00 H new ATOM 0 HA ASP A 185 7.581 4.262 12.971 1.00 0.00 H new ATOM 0 HB2 ASP A 185 5.295 3.569 12.055 1.00 0.00 H new ATOM 0 HB3 ASP A 185 5.903 1.926 12.009 1.00 0.00 H new ATOM 1231 N GLY A 186 9.751 2.583 12.118 1.00 0.00 N ATOM 1232 CA GLY A 186 10.924 1.728 12.354 1.00 0.00 C ATOM 1233 C GLY A 186 10.967 0.457 11.495 1.00 0.00 C ATOM 1234 O GLY A 186 11.889 -0.343 11.655 1.00 0.00 O ATOM 0 H GLY A 186 9.933 3.327 11.444 1.00 0.00 H new ATOM 0 HA2 GLY A 186 11.826 2.310 12.165 1.00 0.00 H new ATOM 0 HA3 GLY A 186 10.944 1.442 13.406 1.00 0.00 H new ATOM 1238 N ARG A 187 9.999 0.269 10.588 1.00 0.00 N ATOM 1239 CA ARG A 187 9.869 -0.901 9.706 1.00 0.00 C ATOM 1240 C ARG A 187 10.177 -0.521 8.252 1.00 0.00 C ATOM 1241 O ARG A 187 9.652 0.470 7.736 1.00 0.00 O ATOM 1242 CB ARG A 187 8.445 -1.471 9.831 1.00 0.00 C ATOM 1243 CG ARG A 187 8.192 -2.168 11.181 1.00 0.00 C ATOM 1244 CD ARG A 187 8.487 -3.671 11.144 1.00 0.00 C ATOM 1245 NE ARG A 187 7.463 -4.398 10.369 1.00 0.00 N ATOM 1246 CZ ARG A 187 7.473 -5.678 10.022 1.00 0.00 C ATOM 1247 NH1 ARG A 187 8.480 -6.479 10.304 1.00 0.00 N ATOM 1248 NH2 ARG A 187 6.435 -6.162 9.380 1.00 0.00 N ATOM 0 H ARG A 187 9.256 0.953 10.442 1.00 0.00 H new ATOM 0 HA ARG A 187 10.589 -1.662 10.008 1.00 0.00 H new ATOM 0 HB2 ARG A 187 7.724 -0.663 9.705 1.00 0.00 H new ATOM 0 HB3 ARG A 187 8.272 -2.182 9.023 1.00 0.00 H new ATOM 0 HG2 ARG A 187 8.811 -1.701 11.946 1.00 0.00 H new ATOM 0 HG3 ARG A 187 7.153 -2.014 11.474 1.00 0.00 H new ATOM 0 HD2 ARG A 187 9.469 -3.841 10.702 1.00 0.00 H new ATOM 0 HD3 ARG A 187 8.523 -4.062 12.161 1.00 0.00 H new ATOM 0 HE ARG A 187 6.655 -3.854 10.066 1.00 0.00 H new ATOM 0 HH11 ARG A 187 9.291 -6.120 10.807 1.00 0.00 H new ATOM 0 HH12 ARG A 187 8.448 -7.458 10.019 1.00 0.00 H new ATOM 0 HH21 ARG A 187 5.644 -5.557 9.159 1.00 0.00 H new ATOM 0 HH22 ARG A 187 6.419 -7.143 9.102 1.00 0.00 H new ATOM 1262 N ARG A 188 11.032 -1.308 7.590 1.00 0.00 N ATOM 1263 CA ARG A 188 11.404 -1.121 6.181 1.00 0.00 C ATOM 1264 C ARG A 188 10.317 -1.692 5.265 1.00 0.00 C ATOM 1265 O ARG A 188 10.094 -2.904 5.217 1.00 0.00 O ATOM 1266 CB ARG A 188 12.775 -1.760 5.886 1.00 0.00 C ATOM 1267 CG ARG A 188 13.949 -1.102 6.636 1.00 0.00 C ATOM 1268 CD ARG A 188 14.165 0.384 6.304 1.00 0.00 C ATOM 1269 NE ARG A 188 14.489 0.606 4.881 1.00 0.00 N ATOM 1270 CZ ARG A 188 15.685 0.492 4.314 1.00 0.00 C ATOM 1271 NH1 ARG A 188 16.757 0.131 4.989 1.00 0.00 N ATOM 1272 NH2 ARG A 188 15.815 0.746 3.032 1.00 0.00 N ATOM 0 H ARG A 188 11.494 -2.107 8.025 1.00 0.00 H new ATOM 0 HA ARG A 188 11.489 -0.053 5.983 1.00 0.00 H new ATOM 0 HB2 ARG A 188 12.736 -2.817 6.150 1.00 0.00 H new ATOM 0 HB3 ARG A 188 12.966 -1.706 4.814 1.00 0.00 H new ATOM 0 HG2 ARG A 188 13.780 -1.201 7.708 1.00 0.00 H new ATOM 0 HG3 ARG A 188 14.863 -1.649 6.406 1.00 0.00 H new ATOM 0 HD2 ARG A 188 13.266 0.944 6.560 1.00 0.00 H new ATOM 0 HD3 ARG A 188 14.972 0.777 6.922 1.00 0.00 H new ATOM 0 HE ARG A 188 13.716 0.874 4.271 1.00 0.00 H new ATOM 0 HH11 ARG A 188 16.687 -0.073 5.986 1.00 0.00 H new ATOM 0 HH12 ARG A 188 17.657 0.056 4.515 1.00 0.00 H new ATOM 0 HH21 ARG A 188 15.003 1.027 2.483 1.00 0.00 H new ATOM 0 HH22 ARG A 188 16.728 0.662 2.585 1.00 0.00 H new ATOM 1286 N ILE A 189 9.627 -0.801 4.559 1.00 0.00 N ATOM 1287 CA ILE A 189 8.481 -1.119 3.688 1.00 0.00 C ATOM 1288 C ILE A 189 8.894 -1.516 2.254 1.00 0.00 C ATOM 1289 O ILE A 189 10.068 -1.460 1.884 1.00 0.00 O ATOM 1290 CB ILE A 189 7.447 0.040 3.693 1.00 0.00 C ATOM 1291 CG1 ILE A 189 7.933 1.281 2.908 1.00 0.00 C ATOM 1292 CG2 ILE A 189 7.032 0.413 5.128 1.00 0.00 C ATOM 1293 CD1 ILE A 189 6.805 2.270 2.606 1.00 0.00 C ATOM 0 H ILE A 189 9.850 0.194 4.572 1.00 0.00 H new ATOM 0 HA ILE A 189 8.005 -2.005 4.108 1.00 0.00 H new ATOM 0 HB ILE A 189 6.565 -0.330 3.170 1.00 0.00 H new ATOM 0 HG12 ILE A 189 8.710 1.787 3.481 1.00 0.00 H new ATOM 0 HG13 ILE A 189 8.387 0.958 1.971 1.00 0.00 H new ATOM 0 HG21 ILE A 189 6.308 1.227 5.097 1.00 0.00 H new ATOM 0 HG22 ILE A 189 6.584 -0.454 5.614 1.00 0.00 H new ATOM 0 HG23 ILE A 189 7.910 0.730 5.690 1.00 0.00 H new ATOM 0 HD11 ILE A 189 7.205 3.120 2.054 1.00 0.00 H new ATOM 0 HD12 ILE A 189 6.039 1.777 2.008 1.00 0.00 H new ATOM 0 HD13 ILE A 189 6.366 2.618 3.541 1.00 0.00 H new ATOM 1305 N ARG A 190 7.896 -1.846 1.429 1.00 0.00 N ATOM 1306 CA ARG A 190 7.963 -2.052 -0.025 1.00 0.00 C ATOM 1307 C ARG A 190 6.667 -1.506 -0.643 1.00 0.00 C ATOM 1308 O ARG A 190 5.613 -1.613 -0.019 1.00 0.00 O ATOM 1309 CB ARG A 190 8.149 -3.552 -0.314 1.00 0.00 C ATOM 1310 CG ARG A 190 8.366 -3.858 -1.806 1.00 0.00 C ATOM 1311 CD ARG A 190 8.477 -5.363 -2.085 1.00 0.00 C ATOM 1312 NE ARG A 190 7.177 -6.046 -1.923 1.00 0.00 N ATOM 1313 CZ ARG A 190 6.841 -6.949 -1.007 1.00 0.00 C ATOM 1314 NH1 ARG A 190 7.669 -7.335 -0.058 1.00 0.00 N ATOM 1315 NH2 ARG A 190 5.640 -7.485 -1.033 1.00 0.00 N ATOM 0 H ARG A 190 6.950 -1.987 1.784 1.00 0.00 H new ATOM 0 HA ARG A 190 8.809 -1.524 -0.464 1.00 0.00 H new ATOM 0 HB2 ARG A 190 9.002 -3.922 0.254 1.00 0.00 H new ATOM 0 HB3 ARG A 190 7.272 -4.095 0.038 1.00 0.00 H new ATOM 0 HG2 ARG A 190 7.539 -3.444 -2.383 1.00 0.00 H new ATOM 0 HG3 ARG A 190 9.273 -3.360 -2.148 1.00 0.00 H new ATOM 0 HD2 ARG A 190 8.846 -5.519 -3.099 1.00 0.00 H new ATOM 0 HD3 ARG A 190 9.208 -5.806 -1.408 1.00 0.00 H new ATOM 0 HE ARG A 190 6.451 -5.795 -2.594 1.00 0.00 H new ATOM 0 HH11 ARG A 190 8.607 -6.938 -0.007 1.00 0.00 H new ATOM 0 HH12 ARG A 190 7.372 -8.031 0.626 1.00 0.00 H new ATOM 0 HH21 ARG A 190 4.973 -7.207 -1.753 1.00 0.00 H new ATOM 0 HH22 ARG A 190 5.376 -8.178 -0.333 1.00 0.00 H new ATOM 1329 N VAL A 191 6.735 -0.911 -1.835 1.00 0.00 N ATOM 1330 CA VAL A 191 5.606 -0.231 -2.504 1.00 0.00 C ATOM 1331 C VAL A 191 5.620 -0.546 -4.001 1.00 0.00 C ATOM 1332 O VAL A 191 6.659 -0.441 -4.654 1.00 0.00 O ATOM 1333 CB VAL A 191 5.641 1.305 -2.289 1.00 0.00 C ATOM 1334 CG1 VAL A 191 4.423 2.001 -2.919 1.00 0.00 C ATOM 1335 CG2 VAL A 191 5.704 1.693 -0.803 1.00 0.00 C ATOM 0 H VAL A 191 7.595 -0.884 -2.382 1.00 0.00 H new ATOM 0 HA VAL A 191 4.686 -0.606 -2.056 1.00 0.00 H new ATOM 0 HB VAL A 191 6.553 1.641 -2.782 1.00 0.00 H new ATOM 0 HG11 VAL A 191 4.487 3.075 -2.745 1.00 0.00 H new ATOM 0 HG12 VAL A 191 4.408 1.807 -3.992 1.00 0.00 H new ATOM 0 HG13 VAL A 191 3.509 1.615 -2.468 1.00 0.00 H new ATOM 0 HG21 VAL A 191 5.726 2.779 -0.711 1.00 0.00 H new ATOM 0 HG22 VAL A 191 4.826 1.303 -0.288 1.00 0.00 H new ATOM 0 HG23 VAL A 191 6.604 1.272 -0.355 1.00 0.00 H new ATOM 1345 N ASP A 192 4.460 -0.915 -4.546 1.00 0.00 N ATOM 1346 CA ASP A 192 4.270 -1.263 -5.959 1.00 0.00 C ATOM 1347 C ASP A 192 2.801 -1.104 -6.390 1.00 0.00 C ATOM 1348 O ASP A 192 1.903 -1.042 -5.549 1.00 0.00 O ATOM 1349 CB ASP A 192 4.772 -2.699 -6.208 1.00 0.00 C ATOM 1350 CG ASP A 192 4.880 -3.042 -7.701 1.00 0.00 C ATOM 1351 OD1 ASP A 192 5.312 -2.157 -8.480 1.00 0.00 O ATOM 1352 OD2 ASP A 192 4.592 -4.199 -8.081 1.00 0.00 O ATOM 0 H ASP A 192 3.600 -0.983 -4.002 1.00 0.00 H new ATOM 0 HA ASP A 192 4.853 -0.572 -6.568 1.00 0.00 H new ATOM 0 HB2 ASP A 192 5.748 -2.824 -5.740 1.00 0.00 H new ATOM 0 HB3 ASP A 192 4.095 -3.404 -5.726 1.00 0.00 H new ATOM 1357 N PHE A 193 2.545 -1.047 -7.698 1.00 0.00 N ATOM 1358 CA PHE A 193 1.192 -0.985 -8.258 1.00 0.00 C ATOM 1359 C PHE A 193 0.346 -2.210 -7.871 1.00 0.00 C ATOM 1360 O PHE A 193 0.833 -3.339 -7.819 1.00 0.00 O ATOM 1361 CB PHE A 193 1.284 -0.814 -9.775 1.00 0.00 C ATOM 1362 CG PHE A 193 1.896 0.505 -10.198 1.00 0.00 C ATOM 1363 CD1 PHE A 193 1.176 1.699 -10.008 1.00 0.00 C ATOM 1364 CD2 PHE A 193 3.172 0.541 -10.794 1.00 0.00 C ATOM 1365 CE1 PHE A 193 1.730 2.930 -10.406 1.00 0.00 C ATOM 1366 CE2 PHE A 193 3.719 1.771 -11.199 1.00 0.00 C ATOM 1367 CZ PHE A 193 3.002 2.963 -10.999 1.00 0.00 C ATOM 0 H PHE A 193 3.278 -1.042 -8.407 1.00 0.00 H new ATOM 0 HA PHE A 193 0.678 -0.123 -7.833 1.00 0.00 H new ATOM 0 HB2 PHE A 193 1.876 -1.630 -10.189 1.00 0.00 H new ATOM 0 HB3 PHE A 193 0.285 -0.896 -10.203 1.00 0.00 H new ATOM 0 HD1 PHE A 193 0.196 1.671 -9.556 1.00 0.00 H new ATOM 0 HD2 PHE A 193 3.728 -0.373 -10.939 1.00 0.00 H new ATOM 0 HE1 PHE A 193 1.178 3.846 -10.256 1.00 0.00 H new ATOM 0 HE2 PHE A 193 4.693 1.800 -11.665 1.00 0.00 H new ATOM 0 HZ PHE A 193 3.431 3.907 -11.302 1.00 0.00 H new